(Q27188207)

SMR000014225 (English)

10 October 2016

chemical formula

C₁₈H₁₂N₂O₃S

1 reference

SMR000014225 (English)

10 October 2016

canonical SMILES

C1=CC=C(C=C1)C2=NC3=C(C(=N2)SCC(=O)O)OC4=CC=CC=C43

1 reference

SMR000014225 (English)

InChI=1S/C18H12N2O3S/c21-14(22)10-24-18-16-15(12-8-4-5-9-13(12)23-16)19-17(20-18)11-6-2-1-3-7-11/h1-9H,10H2,(H,21,22)

10 October 2016

Identifiers

InChI

1 reference

SMR000014225 (English)

JJPOVMZLCXNDCU-UHFFFAOYSA-N

10 October 2016

InChIKey

2 references

SMR000014225 (English)

10 October 2016

stated in

ChEBI release 2020-09-01

1 reference

[(2-Phenyl[1]benzofuro[3,2-d]pyrimidin-4-yl)sulfanyl]acetic acid (English)

10 October 2016

2 references

SMR000014225 (English)

matched by identifier from

10 October 2016

InChIKey

JJPOVMZLCXNDCU-UHFFFAOYSA-N

ChEBI ID

109141

mapping relation type

2 references

2-[(2-phenyl-4-benzofuro[3,2-d]pyrimidinyl)thio]acetic acid (English)

matched by identifier from

10 October 2016

International Chemical Identifier

InChI

InChI=1S/C18H12N2O3S/c21-14(22)10-24-18-16-15(12-8-4-5-9-13(12)23-16)19-17(20-18)11-6-2-1-3-7-11/h1-9H,10H2,(H,21,22)

1 reference