(Q27096626)

(4r)-N-[4-({[2-(Dimethylamino)ethyl]amino}carbonyl)-1,3-Thiazol-2-Yl]-4-Methyl-1-Oxo-2,3,4,9-Tetrahydro-1h-Beta-Carboline-6-Carboxamide (English)

19 October 2016

chemical formula

C₂₁H₂₄N₆O₃S

1 reference

(4r)-N-[4-({[2-(Dimethylamino)ethyl]amino}carbonyl)-1,3-Thiazol-2-Yl]-4-Methyl-1-Oxo-2,3,4,9-Tetrahydro-1h-Beta-Carboline-6-Carboxamide (English)

19 October 2016

canonical SMILES

CC1CNC(=O)C2=C1C3=C(N2)C=CC(=C3)C(=O)NC4=NC(=CS4)C(=O)NCCN(C)C

1 reference

(4r)-N-[4-({[2-(Dimethylamino)ethyl]amino}carbonyl)-1,3-Thiazol-2-Yl]-4-Methyl-1-Oxo-2,3,4,9-Tetrahydro-1h-Beta-Carboline-6-Carboxamide (English)

19 October 2016

isomeric SMILES

C[C@H]1CNC(=O)C2=C1C3=C(N2)C=CC(=C3)C(=O)NC4=NC(=CS4)C(=O)NCCN(C)C

1 reference

(4r)-N-[4-({[2-(Dimethylamino)ethyl]amino}carbonyl)-1,3-Thiazol-2-Yl]-4-Methyl-1-Oxo-2,3,4,9-Tetrahydro-1h-Beta-Carboline-6-Carboxamide (English)

InChI=1S/C21H24N6O3S/c1-11-9-23-20(30)17-16(11)13-8-12(4-5-14(13)24-17)18(28)26-21-25-15(10-31-21)19(29)22-6-7-27(2)3/h4-5,8,10-11,24H,6-7,9H2,1-3H3,(H,22,29)(H,23,30)(H,25,26,28)/t11-/m0/s1

19 October 2016

Identifiers

InChI

1 reference

(4r)-N-[4-({[2-(Dimethylamino)ethyl]amino}carbonyl)-1,3-Thiazol-2-Yl]-4-Methyl-1-Oxo-2,3,4,9-Tetrahydro-1h-Beta-Carboline-6-Carboxamide (English)

QWFFPYQWUWLDBV-NSHDSACASA-N

19 October 2016

InChIKey

1 reference

(4r)-N-[4-({[2-(Dimethylamino)ethyl]amino}carbonyl)-1,3-Thiazol-2-Yl]-4-Methyl-1-Oxo-2,3,4,9-Tetrahydro-1h-Beta-Carboline-6-Carboxamide (English)

19 October 2016

1 reference

(4R)-N-(4-{[2-(Dimethylamino)ethyl]carbamoyl}-1,3-thiazol-2-yl)-4-methyl-1-oxo-2,3,4,9-tetrahydro-1H-beta-carboline-6-carboxamide (English)

19 October 2016

2 references

(4r)-N-[4-({[2-(Dimethylamino)ethyl]amino}carbonyl)-1,3-Thiazol-2-Yl]-4-Methyl-1-Oxo-2,3,4,9-Tetrahydro-1h-Beta-Carboline-6-Carboxamide (English)

matched by identifier from

19 October 2016

InChIKey

QWFFPYQWUWLDBV-NSHDSACASA-N

1 reference

1 reference

matched by identifier from

InChIKey

QWFFPYQWUWLDBV-NSHDSACASA-N

0 references

0 references

1 reference

2PZY (English)