Vitas-M small molecule compound
N-(4-methoxyphenyl)-5-methyl-7-(4-nitrophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK180865
SMILES COc1ccc(cc1)NC(=O)C1=C(C)Nc2n(C1c1ccc(cc1)[N+](=O)[O-])ncn2
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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 C20H18N6O4 MW 406.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N6O4/c1-12-17(19(27)24-14-5-9-16(30-2)10-6-14)18(25-20(23-12)21-11-22-25)13-3-7-15(8-4-13)26(28)29/h3-11,18H,1-2H3,(H,24,27)(H,21,22,23)InChIKey
GOGACJAGKQCXOE-UHFFFAOYSA-NSynonyms
CC1=C(C(N2C(=N1)N=CN2)C3=CC=C(C=C3)(N+)(=O)(O))C(=O)NC4=CC=C(C=C4)OC
COc1ccc(cc1)NC(=O)C1=C(C)Nc2n(C1c1ccc(cc1)(N+)(=O)(O))ncn2
InChI=1SC20H18N6O4c11217(19(27)24145916(302)10614)18(2520(2312)21112225)133715(8413)26(28)29h31118H12H3(H2427)(H212223)
MFCD06757458
N(4methoxyphenyl)5methyl7(4nitrophenyl)17dihydro(124)triazolo(15a)pyrimidine6carboxamide
N(4METHOXYPHENYL)5METHYL7(4NITROPHENYL)47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXAMIDE
ZINC000004705338
ZINC000004705339
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