Vitas-M small molecule compound
methyl 4-(2,4-dimethylphenyl)-6-{[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL435866
SMILES COC(=O)C1=C(CSc2[nH]c3c(n2)cc(cc3)C)NC(=O)NC1c1ccc(cc1C)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 C23H24N4O3S MW 436.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N4O3S/c1-12-5-7-15(14(3)9-12)20-19(21(28)30-4)18(24-22(29)27-20)11-31-23-25-16-8-6-13(2)10-17(16)26-23/h5-10,20H,11H2,1-4H3,(H,25,26)(H2,24,27,29)InChIKey
MUDGESLWNVOZBT-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1)C2C(=C(NC(=O)N2)CSC3=NC4=C(N3)C=C(C=C4)C)C(=O)OC)C
COC(=O)C1=C(CSc2(nH)c3c(n2)cc(cc3)C)NC(=O)NC1c1ccc(cc1C)C
InChI=1SC23H24N4O3Sc1125715(14(3)912)2019(21(28)304)18(2422(29)2720)11312325168613(2)1017(16)2623h51020H11H214H3(H2526)(H2242729)
methyl4(24dimethylphenyl)6(((5methyl1Hbenzimidazol2yl)sulfanyl)methyl)2oxo1234tetrahydropyrimidine5carboxylate
methyl4(24dimethylphenyl)6((6methyl1Hbenzimidazol2yl)sulfanylmethyl)2oxo34dihydro1Hpyrimidine5carboxylate
METHYL6(24DIMETHYLPHENYL)4((5METHYLBENZIMIDAZOL2YLTHIO)METHYL)2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
MFCD07048884
ZINC000008816197
ZINC000008816198
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