Vitas-M small molecule compound

N-(3-chloro-2-methylphenyl)-2-{[3-(4-ethoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide

Catalog ID
STL297144
SMILES CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2C)Cl)nc2c(c1=O)c1CCCCc1s2

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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 C27H26ClN3O3S2 MW 540.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26ClN3O3S2/c1-3-34-18-13-11-17(12-14-18)31-26(33)24-19-7-4-5-10-22(19)36-25(24)30-27(31)35-15-23(32)29-21-9-6-8-20(28)16(21)2/h6,8-9,11-14H,3-5,7,10,15H2,1-2H3,(H,29,32)
InChIKey
SKFGVJSENUKFFI-UHFFFAOYSA-N
Synonyms
613226-84-9
613226849
CCOC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)NC4=C(C(=CC=C4)Cl)C)SC5=C3CCCC5
InChI=1SC27H26ClN3O3S2c133418131117(121418)3126(33)24197451022(19)3625(24)3027(31)351523(32)292196820(28)16(21)2h6891114H3571015H212H3(H2932)
MFCD03224569
N(3chloro2methylphenyl)2((3(4ethoxyphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetamide
N(3chloro2methylphenyl)2((3(4ethoxyphenyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetamide
N(3chloro2methylphenyl)2((3(4ethoxyphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetamide
ZINC000002224423
ZINC2224423

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Available files

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