Vitas-M small molecule compound
5-methyl-N-(2-methylphenyl)-7-(3-nitrophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK180863
SMILES CC1=C(C(=O)Nc2ccccc2C)C(n2c(N1)ncn2)c1cccc(c1)[N+](=O)[O-]
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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 C20H18N6O3 MW 390.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N6O3/c1-12-6-3-4-9-16(12)24-19(27)17-13(2)23-20-21-11-22-25(20)18(17)14-7-5-8-15(10-14)26(28)29/h3-11,18H,1-2H3,(H,24,27)(H,21,22,23)InChIKey
JJSBVCXBAJZYOO-UHFFFAOYSA-NSynonyms
694501-06-95METHYLN(2METHYLPHENYL)7(3NITROPHENYL)17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXAMIDE
5METHYLN(2METHYLPHENYL)7(3NITROPHENYL)47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXAMIDE
694501069
CC1=C(C(=O)Nc2ccccc2C)C(n2c(N1)ncn2)c1cccc(c1)(N+)(=O)(O)
CC1=CC=CC=C1NC(=O)C2=C(N=C3N=CNN3C2C4=CC(=CC=C4)(N+)(=O)(O))C
InChI=1SC20H18N6O3c112634916(12)2419(27)1713(2)232021112225(20)18(17)1475815(1014)26(28)29h31118H12H3(H2427)(H212223)
MFCD04214637
ZINC000001131223
ZINC000001131226
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