Vitas-M small molecule compound
methyl 4-(4-methylphenyl)-6-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL435789
SMILES COC(=O)C1=C(CSc2nnnn2C)NC(=O)NC1c1ccc(cc1)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 C16H18N6O3S MW 374.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N6O3S/c1-9-4-6-10(7-5-9)13-12(14(23)25-3)11(17-15(24)18-13)8-26-16-19-20-21-22(16)2/h4-7,13H,8H2,1-3H3,(H2,17,18,24)InChIKey
FMUPSSANPNVINQ-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)C2C(=C(NC(=O)N2)CSC3=NN=NN3C)C(=O)OC
InChI=1SC16H18N6O3Sc194610(759)1312(14(23)253)11(1715(24)1813)8261619202122(16)2h4713H8H213H3(H2171824)
methyl4(4methylphenyl)6(((1methyl1Htetrazol5yl)sulfanyl)methyl)2oxo1234tetrahydropyrimidine5carboxylate
METHYL4(4METHYLPHENYL)6((1METHYLTETRAZOL5YL)SULFANYLMETHYL)2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
MFCD07155733
ZINC000005018474
ZINC000005018476
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