Vitas-M small molecule compound

2-(1H-benzimidazol-2-ylsulfanyl)-N-[2-(4-{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}phenyl)-4-phenylquinazolin-6-yl]acetamide

Catalog ID
STK354902
SMILES O=C(Nc1ccc(cc1)c1nc2ccc(cc2c(n1)c1ccccc1)NC(=O)CSc1nc2c([nH]1)cccc2)CSc1nc2c([nH]1)cccc2

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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 C38H28N8O2S2 MW 692.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H28N8O2S2/c47-33(21-49-37-42-29-10-4-5-11-30(29)43-37)39-25-16-14-24(15-17-25)36-41-28-19-18-26(20-27(28)35(46-36)23-8-2-1-3-9-23)40-34(48)22-50-38-44-31-12-6-7-13-32(31)45-38/h1-20H,21-22H2,(H,39,47)(H,40,48)(H,42,43)(H,44,45)
InChIKey
BAFBSUDVPNASAV-UHFFFAOYSA-N
Synonyms
348140-18-1
2(1Hbenzimidazol2ylsulfanyl)N(2(4(((1Hbenzimidazol2ylsulfanyl)acetyl)amino)phenyl)4phenylquinazolin6yl)acetamide
2(1Hbenzimidazol2ylsulfanyl)N(4(6((2(1Hbenzimidazol2ylsulfanyl)acetyl)amino)4phenylquinazolin2yl)phenyl)acetamide
2BENZIMIDAZOL2YLTHION(2(4(2BENZIMIDAZOL2YLTHIOACETYLAMINO)PHENYL)4PHENYLQUINAZOLIN6YL)ACETAMIDE
348140181
C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)NC(=O)CSC4=NC5=CC=CC=C5N4)C6=CC=C(C=C6)NC(=O)CSC7=NC8=CC=CC=C8N7
InChI=1SC38H28N8O2S2c4733(214937422910451130(29)4337)3925161424(151725)364128191826(2027(28)35(4636)238213923)4034(48)225038443112671332(31)4538h120H2122H2(H3947)(H4048)(H4243)(H4445)
MFCD01443499
O=C(Nc1ccc(cc1)c1nc2ccc(cc2c(n1)c1ccccc1)NC(=O)CSc1nc2c((nH)1)cccc2)CSc1nc2c((nH)1)cccc2
ZINC000098043404
ZINC98043404

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Available files

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