Vitas-M small molecule compound
2-(4-{[3-(3-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}butyl)-1H-isoindole-1,3(2H)-dione
Catalog ID
STK720761
SMILES Cc1cccc(c1)n1c(SCCCCN2C(=O)c3c(C2=O)cccc3)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 C29H27N3O3S2 MW 529.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N3O3S2/c1-18-9-8-10-19(17-18)32-28(35)24-22-13-4-5-14-23(22)37-25(24)30-29(32)36-16-7-6-15-31-26(33)20-11-2-3-12-21(20)27(31)34/h2-3,8-12,17H,4-7,13-16H2,1H3InChIKey
SENYEYNJNSKYRH-UHFFFAOYSA-NSynonyms
371213-02-42(4((3(3methylphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)butyl)1Hisoindole13(2H)dione
2(4((3(3methylphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)butyl)isoindole13dione
2(4((4oxo3(mtolyl)345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)butyl)isoindoline13dione
371213024
CC1=CC(=CC=C1)N2C(=O)C3=C(N=C2SCCCCN4C(=O)C5=CC=CC=C5C4=O)SC6=C3CCCC6
InChI=1SC29H27N3O3S2c118981019(1718)3228(35)242213451423(22)3725(24)3029(32)361676153126(33)2011231221(20)27(31)34h2381217H471316H21H3
MFCD03010028
ZINC000001827310
ZINC01827310
ZINC1827310
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