(Q76856370)

English

4-[[4-[[4-[4-[(E)-2-cyanoethenyl]-2,6-dimethylphenoxy]thieno[3,2-d]pyrimidin-2-yl]amino]piperidin-1-yl]methyl]benzenesulfonamide

chemical compound

In more languages

Statements

type of chemical entity

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chemical compound

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574.1820808199999 dalton

1 reference

based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₉H₃₀N₆O₃S₂

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canonical SMILES

Cc1cc(cc(c1Oc2c3c(ccs3)nc(n2)NC4CCN(CC4)Cc5ccc(cc5)S(=O)(=O)N)C)C=CC#N

1 reference

RCSB protein data bank

language of work or name

16 February 2021

isomeric SMILES

CC1=CC(=CC(=C1OC2=NC(=NC3=C2SC=C3)NC4CCN(CC4)CC5=CC=C(C=C5)S(=O)(=O)N)C)/C=C/C#N

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Identifiers

InChI=1S/C29H30N6O3S2/c1-19-16-22(4-3-12-30)17-20(2)26(19)38-28-27-25(11-15-39-27)33-29(34-28)32-23-9-13-35(14-10-23)18-21-5-7-24(8-6-21)40(31,36)37/h3-8,11,15-17,23H,9-10,13-14,18H2,1-2H3,(H2,31,36,37)(H,32,33,34)/b4-3+

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GVCHBMCBPBRORW-ONEGZZNKSA-N

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1 reference

matched by identifier from

GVCHBMCBPBRORW-ONEGZZNKSA-N

UniChem compound ID

1 reference

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