Vitas-M small molecule compound
N-benzyl-2-{[7-benzyl-3-(3-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STK543399
SMILES O=C(CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCN(C3)Cc1ccccc1)NCc1ccccc1
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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 C32H30N4O2S2 MW 566.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30N4O2S2/c1-22-9-8-14-25(17-22)36-31(38)29-26-15-16-35(19-24-12-6-3-7-13-24)20-27(26)40-30(29)34-32(36)39-21-28(37)33-18-23-10-4-2-5-11-23/h2-14,17H,15-16,18-21H2,1H3,(H,33,37)InChIKey
XKASQJBDTPQJID-UHFFFAOYSA-NSynonyms
CC1=CC(=CC=C1)N2C(=O)C3=C(N=C2SCC(=O)NCC4=CC=CC=C4)SC5=C3CCN(C5)CC6=CC=CC=C6
InChI=1SC32H30N4O2S2c122981425(1722)3631(38)2926151635(1924126371324)2027(26)4030(29)3432(36)392128(37)331823104251123h21417H15161821H21H3(H3337)
MFCD03302045
Nbenzyl2((7benzyl3(3methylphenyl)4oxo345678hexahydropyrido(4345)thieno(23d)pyrimidin2yl)sulfanyl)acetamide
Nbenzyl2((7benzyl3(3methylphenyl)4oxo68dihydro5Hpyrido(23)thieno(24b)pyrimidin2yl)sulfanyl)acetamide
Nbenzyl2((7benzyl4oxo3(mtolyl)345678hexahydropyrido(4345)thieno(23d)pyrimidin2yl)thio)acetamide
ZINC000053340678
ZINC53340678
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