Vitas-M small molecule compound

4-[({[3-(4-chlorophenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]benzamide

Catalog ID
STK554653
SMILES O=C(Nc1ccc(cc1)C(=O)N)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)Cl)CCCC3

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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 C25H21ClN4O3S2 MW 525.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN4O3S2/c26-15-7-11-17(12-8-15)30-24(33)21-18-3-1-2-4-19(18)35-23(21)29-25(30)34-13-20(31)28-16-9-5-14(6-10-16)22(27)32/h5-12H,1-4,13H2,(H2,27,32)(H,28,31)
InChIKey
MHQQJPTVZURYBV-UHFFFAOYSA-N
Synonyms
723322-76-7
4((((3(4chlorophenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetyl)amino)benzamide
4((2((3(4chlorophenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetyl)amino)benzamide
4(2((3(4chlorophenyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetamido)benzamide
723322767
C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)C4=CC=C(C=C4)Cl)SCC(=O)NC5=CC=C(C=C5)C(=O)N
InChI=1SC25H21ClN4O3S2c261571117(12815)3024(33)2118312419(18)3523(21)2925(30)341320(31)28169514(61016)22(27)32h512H1413H2(H22732)(H2831)
MFCD03223886
ZINC000002263027
ZINC2263027

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Available files

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