Vitas-M small molecule compound

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

Catalog ID
STK097338
SMILES COc1ccc(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 C26H24ClN3O3S2 MW 526.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24ClN3O3S2/c1-15-19(27)7-5-8-20(15)28-22(31)14-34-26-29-24-23(18-6-3-4-9-21(18)35-24)25(32)30(26)16-10-12-17(33-2)13-11-16/h5,7-8,10-13H,3-4,6,9,14H2,1-2H3,(H,28,31)
InChIKey
PNDUTNJUBSUKIL-UHFFFAOYSA-N
Synonyms
477331-36-5
477331365
CC1=C(C=CC=C1Cl)NC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=C(C=C5)OC
COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2C)Cl)nc2c(c1=O)c1CCCCc1s2
InChI=1SC26H24ClN3O3S2c11519(27)75820(15)2822(31)143426292423(18634921(18)3524)25(32)30(26)16101217(332)131116h5781013H346914H212H3(H2831)
MFCD03223555
N(3chloro2methylphenyl)2((3(4methoxyphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetamide
N(3chloro2methylphenyl)2((3(4methoxyphenyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetamide
N(3chloro2methylphenyl)2((3(4methoxyphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetamide
STK097338
ZINC000001827392
ZINC01827392
ZINC1827392

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Available files

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