Vitas-M small molecule compound
6-methyl-3-(4-methylphenyl)-2-{[2-oxo-2-(pyrrolidin-1-yl)ethyl]sulfanyl}-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Catalog ID
STL093425
SMILES Cc1ccc(cc1)n1c(SCC(=O)N2CCCC2)nc2c(c1=O)[nH]c(c2)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 C20H22N4O2S MW 382.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O2S/c1-13-5-7-15(8-6-13)24-19(26)18-16(11-14(2)21-18)22-20(24)27-12-17(25)23-9-3-4-10-23/h5-8,11,21H,3-4,9-10,12H2,1-2H3InChIKey
IALVUHIXLBANFI-UHFFFAOYSA-NSynonyms
6methyl3(4methylphenyl)2((2oxo2(pyrrolidin1yl)ethyl)sulfanyl)35dihydro4Hpyrrolo(32d)pyrimidin4one
6methyl3(4methylphenyl)2(2oxo2pyrrolidin1ylethyl)sulfanyl5Hpyrrolo(32d)pyrimidin4one
CC1=CC=C(C=C1)N2C(=O)C3=C(C=C(N3)C)N=C2SCC(=O)N4CCCC4
Cc1ccc(cc1)n1c(SCC(=O)N2CCCC2)nc2c(c1=O)(nH)c(c2)C
InChI=1SC20H22N4O2Sc1135715(8613)2419(26)1816(1114(2)2118)2220(24)271217(25)239341023h581121H3491012H212H3
MFCD18787559
ZINC000067236960
ZINC67236960
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