Vitas-M small molecule compound
N-(4-chlorophenyl)-2-{[3-(3-methylphenyl)-4-oxo-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STK552712
SMILES O=C(Nc1ccc(cc1)Cl)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)C(C)C
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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 C27H26ClN3O3S2 MW 540.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26ClN3O3S2/c1-15(2)21-12-20-22(13-34-21)36-25-24(20)26(33)31(19-6-4-5-16(3)11-19)27(30-25)35-14-23(32)29-18-9-7-17(28)8-10-18/h4-11,15,21H,12-14H2,1-3H3,(H,29,32)InChIKey
YCJVVFVALGCGCU-UHFFFAOYSA-NSynonyms
836626-19-8836626198
CC1=CC(=CC=C1)N2C(=O)C3=C(N=C2SCC(=O)NC4=CC=C(C=C4)Cl)SC5=C3CC(OC5)C(C)C
InChI=1SC27H26ClN3O3S2c115(2)21122022(133421)362524(20)26(33)31(1964516(3)1119)27(3025)351423(32)29189717(28)81018h4111521H1214H213H3(H2932)
MFCD03688234
N(4chlorophenyl)2((3(3methylphenyl)4oxo6(propan2yl)3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin2yl)sulfanyl)acetamide
N(4chlorophenyl)2((3(3methylphenyl)4oxo6propan2yl68dihydro5Hpyrano(23)thieno(24b)pyrimidin2yl)sulfanyl)acetamide
N(4chlorophenyl)2((6isopropyl4oxo3(mtolyl)4568tetrahydro3Hpyrano(4345)thieno(23d)pyrimidin2yl)thio)acetamide
ZINC000097952307
ZINC000097952308
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