Vitas-M small molecule compound
2-(4-{[6,6-dimethyl-3-(3-methylphenyl)-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}butyl)-1H-isoindole-1,3(2H)-dione
Catalog ID
STK541032
SMILES Cc1cccc(c1)n1c(SCCCCN2C(=O)c3c(C2=O)cccc3)nc2c(c1=O)c1CC(C)(C)OCc1s2
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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 C30H29N3O4S2 MW 559.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N3O4S2/c1-18-9-8-10-19(15-18)33-28(36)24-22-16-30(2,3)37-17-23(22)39-25(24)31-29(33)38-14-7-6-13-32-26(34)20-11-4-5-12-21(20)27(32)35/h4-5,8-12,15H,6-7,13-14,16-17H2,1-3H3InChIKey
XJLAUVYIWVXGLV-UHFFFAOYSA-NSynonyms
2(4((66dimethyl3(3methylphenyl)4oxo3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin2yl)sulfanyl)butyl)1Hisoindole13(2H)dione
2(4((66dimethyl3(3methylphenyl)4oxo58dihydropyrano(23)thieno(24b)pyrimidin2yl)sulfanyl)butyl)isoindole13dione
2(4((66dimethyl4oxo3(mtolyl)4568tetrahydro3Hpyrano(4345)thieno(23d)pyrimidin2yl)thio)butyl)isoindoline13dione
CC1=CC(=CC=C1)N2C(=O)C3=C(N=C2SCCCCN4C(=O)C5=CC=CC=C5C4=O)SC6=C3CC(OC6)(C)C
InChI=1SC30H29N3O4S2c118981019(1518)3328(36)24221630(23)371723(22)3925(24)3129(33)381476133226(34)2011451221(20)27(32)35h4581215H6713141617H213H3
MFCD03011254
ZINC000102428971
ZINC102428971
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