Vitas-M small molecule compound
N-(3-cyanophenyl)-2-[3-(4-methylbenzyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide
Catalog ID
STK879245
SMILES N#Cc1cccc(c1)NC(=O)Cn1cnc2c(c1=O)nnn2Cc1ccc(cc1)C
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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 C21H17N7O2 MW 399.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N7O2/c1-14-5-7-15(8-6-14)11-28-20-19(25-26-28)21(30)27(13-23-20)12-18(29)24-17-4-2-3-16(9-17)10-22/h2-9,13H,11-12H2,1H3,(H,24,29)InChIKey
ZFDXLURZTCOOAX-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)CN2C3=C(C(=O)N(C=N3)CC(=O)NC4=CC=CC(=C4)C#N)N=N2
InChI=1SC21H17N7O2c1145715(8614)11282019(252628)21(30)27(132320)1218(29)241742316(917)1022h2913H1112H21H3(H2429)
MFCD18170592
N(3cyanophenyl)2(3((4methylphenyl)methyl)7oxotriazolo(45d)pyrimidin6yl)acetamide
N(3cyanophenyl)2(3(4methylbenzyl)7oxo37dihydro6H(123)triazolo(45d)pyrimidin6yl)acetamide
ZINC000040478037
ZINC40478037
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