Vitas-M small molecule compound

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

Catalog ID
STK543785
SMILES COc1ccc(cc1)NC(=O)CSc1nc2sc3c(c2c(=O)n1CCc1ccccc1)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 C27H27N3O3S2 MW 505.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O3S2/c1-33-20-13-11-19(12-14-20)28-23(31)17-34-27-29-25-24(21-9-5-6-10-22(21)35-25)26(32)30(27)16-15-18-7-3-2-4-8-18/h2-4,7-8,11-14H,5-6,9-10,15-17H2,1H3,(H,28,31)
InChIKey
BYFLACHCSGPZBI-UHFFFAOYSA-N
Synonyms
489399-22-6
489399226
COC1=CC=C(C=C1)NC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2CCC5=CC=CC=C5
InChI=1SC27H27N3O3S2c13320131119(121420)2823(31)173427292524(219561022(21)3525)26(32)30(27)1615187324818h24781114H569101517H21H3(H2831)
MFCD03295727
N(4methoxyphenyl)2((4oxo3(2phenylethyl)345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetamide
N(4methoxyphenyl)2((4oxo3(2phenylethyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetamide
N(4methoxyphenyl)2((4oxo3phenethyl345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetamide
ZINC000001245813
ZINC01245813
ZINC1245813

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Available files

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