Vitas-M small molecule compound
N-(2,4-dimethylphenyl)-5-methyl-7-(3-nitrophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK174965
SMILES Cc1ccc(c(c1)C)NC(=O)C1=C(C)Nc2n(C1c1cccc(c1)[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 C21H20N6O3 MW 404.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N6O3/c1-12-7-8-17(13(2)9-12)25-20(28)18-14(3)24-21-22-11-23-26(21)19(18)15-5-4-6-16(10-15)27(29)30/h4-11,19H,1-3H3,(H,25,28)(H,22,23,24)InChIKey
SFGZZGFUQFHTIL-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1)NC(=O)C2=C(N=C3N=CNN3C2C4=CC(=CC=C4)(N+)(=O)(O))C)C
Cc1ccc(c(c1)C)NC(=O)C1=C(C)Nc2n(C1c1cccc(c1)(N+)(=O)(O))ncn2
InChI=1SC21H20N6O3c1127817(13(2)912)2520(28)1814(3)242122112326(21)19(18)1554616(1015)27(29)30h41119H13H3(H2528)(H222324)
MFCD06757455
N(24dimethylphenyl)5methyl7(3nitrophenyl)17dihydro(124)triazolo(15a)pyrimidine6carboxamide
N(24DIMETHYLPHENYL)5METHYL7(3NITROPHENYL)47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXAMIDE
ZINC000004704197
ZINC000004704198
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