Vitas-M small molecule compound
methyl 2-{[3-(3-methylphenyl)-4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}propanoate
Catalog ID
STK720945
SMILES COC(=O)C(Sc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCC3)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 C20H20N2O3S2 MW 400.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O3S2/c1-11-6-4-7-13(10-11)22-18(23)16-14-8-5-9-15(14)27-17(16)21-20(22)26-12(2)19(24)25-3/h4,6-7,10,12H,5,8-9H2,1-3H3InChIKey
GWOKSAXZNMHPCB-UHFFFAOYSA-NSynonyms
371136-59-3371136593
CC1=CC(=CC=C1)N2C(=O)C3=C(N=C2SC(C)C(=O)OC)SC4=C3CCC4
InChI=1SC20H20N2O3S2c11164713(1011)2218(23)161485915(14)2717(16)2120(22)2612(2)19(24)253h4671012H589H213H3
methyl2((2(3methylphenyl)1oxo78dihydro6Hcyclopenta(23)thieno(24b)pyrimidin3yl)sulfanyl)propanoate
methyl2((3(3methylphenyl)4oxo3567tetrahydro4Hcyclopenta(45)thieno(23d)pyrimidin2yl)sulfanyl)propanoate
methyl2((4oxo3(mtolyl)4567tetrahydro3Hcyclopenta(45)thieno(23d)pyrimidin2yl)thio)propanoate
MFCD03008740
ZINC000001302082
ZINC000001302083
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