Vitas-M small molecule compound
methyl 4-(4-methoxyphenyl)-6-{[(1-methyl-1H-1,2,4-triazol-5-yl)sulfanyl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL435771
SMILES COC(=O)C1=C(CSc2ncnn2C)NC(=O)NC1c1ccc(cc1)OC
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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 C17H19N5O4S MW 389.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N5O4S/c1-22-17(18-9-19-22)27-8-12-13(15(23)26-3)14(21-16(24)20-12)10-4-6-11(25-2)7-5-10/h4-7,9,14H,8H2,1-3H3,(H2,20,21,24)InChIKey
FBMHMIFRSXKJER-UHFFFAOYSA-NSynonyms
CN1C(=NC=N1)SCC2=C(C(NC(=O)N2)C3=CC=C(C=C3)OC)C(=O)OC
InChI=1SC17H19N5O4Sc12217(1891922)2781213(15(23)263)14(2116(24)2012)104611(252)7510h47914H8H213H3(H2202124)
methyl4(4methoxyphenyl)6(((1methyl1H124triazol5yl)sulfanyl)methyl)2oxo1234tetrahydropyrimidine5carboxylate
METHYL4(4METHOXYPHENYL)6((2METHYL124TRIAZOL3YL)SULFANYLMETHYL)2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
MFCD07155709
ZINC000005018383
ZINC000005018387
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