Vitas-M small molecule compound
N-(2-methoxyphenyl)-5-methyl-7-(2-nitrophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK977217
SMILES COc1ccccc1NC(=O)C1=C(C)Nc2n(C1c1ccccc1[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)24-14-8-4-6-10-16(14)30-2)18(25-20(23-12)21-11-22-25)13-7-3-5-9-15(13)26(28)29/h3-11,18H,1-2H3,(H,24,27)(H,21,22,23)InChIKey
AJYGBLZZDRPIML-UHFFFAOYSA-NSynonyms
CC1=C(C(N2C(=N1)N=CN2)C3=CC=CC=C3(N+)(=O)(O))C(=O)NC4=CC=CC=C4OC
COc1ccccc1NC(=O)C1=C(C)Nc2n(C1c1ccccc1(N+)(=O)(O))ncn2
InChI=1SC20H18N6O4c11217(19(27)24148461016(14)302)18(2520(2312)21112225)13735915(13)26(28)29h31118H12H3(H2427)(H212223)
MFCD03618876
N(2METHOXYPHENYL)(5METHYL7(2NITROPHENYL)(478TRIHYDRO124TRIAZOLO(15A)PYRIMIDIN6YL))CARBOXAMIDE
N(2METHOXYPHENYL)5METHYL7(2NITROPHENYL)17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXAMIDE
N(2methoxyphenyl)5methyl7(2nitrophenyl)47dihydro(124)triazolo(15a)pyrimidine6carboxamide
ZINC000000940459
ZINC000000940460
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