Vitas-M small molecule compound

2-{[9-(benzylsulfanyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl]sulfanyl}-N-(2,4-dimethoxyphenyl)acetamide

Catalog ID
STK721669
SMILES COc1cc(OC)ccc1NC(=O)CSc1nc(SCc2ccccc2)nc2c1sc1c2c2CCCc2c(n1)c1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C35H30N4O3S3 MW 650.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H30N4O3S3/c1-41-23-16-17-26(27(18-23)42-2)36-28(40)20-43-34-32-31(38-35(39-34)44-19-21-10-5-3-6-11-21)29-24-14-9-15-25(24)30(37-33(29)45-32)22-12-7-4-8-13-22/h3-8,10-13,16-18H,9,14-15,19-20H2,1-2H3,(H,36,40)
InChIKey
YVIYIWWOABXSSM-UHFFFAOYSA-N
Synonyms

2((9(benzylsulfanyl)4phenyl23dihydro1Hcyclopenta(45)pyrido(3245)thieno(32d)pyrimidin7yl)sulfanyl)N(24dimethoxyphenyl)acetamide
2((9(benzylthio)4phenyl23dihydro1Hcyclopenta(45)pyrido(3245)thieno(32d)pyrimidin7yl)thio)N(24dimethoxyphenyl)acetamide
COC1=CC(=C(C=C1)NC(=O)CSC2=NC(=NC3=C2SC4=NC(=C5CCCC5=C34)C6=CC=CC=C6)SCC7=CC=CC=C7)OC
InChI=1SC35H30N4O3S3c14123161726(27(1823)422)3628(40)2043343231(3835(3934)441921105361121)29241491525(24)30(3733(29)4532)22127481322h3810131618H914151920H212H3(H3640)
MFCD04079984
ZINC000097999895
ZINC97999895

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Available files

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