Vitas-M small molecule compound
2-benzyl-5-{[(4-chlorophenyl)amino]methyl}-1,2-dihydro-3H-1,2,4-triazol-3-one
Catalog ID
STK940381
SMILES Clc1ccc(cc1)NCc1[nH]n(c(=O)n1)Cc1ccccc1
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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 C16H15ClN4O MW 314.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15ClN4O/c17-13-6-8-14(9-7-13)18-10-15-19-16(22)21(20-15)11-12-4-2-1-3-5-12/h1-9,18H,10-11H2,(H,19,20,22)InChIKey
WMUSOJDEVPAWNL-UHFFFAOYSA-NSynonyms
1219588-66-51219588665
2benzyl5(((4chlorophenyl)amino)methyl)12dihydro3H124triazol3one
2benzyl5(((4chlorophenyl)amino)methyl)1H124triazol3(2H)one
2benzyl5((4chloroanilino)methyl)1H124triazol3one
C1=CC=C(C=C1)CN2C(=O)N=C(N2)CNC3=CC=C(C=C3)Cl
Clc1ccc(cc1)NCc1(nH)n(c(=O)n1)Cc1ccccc1
InChI=1SC16H15ClN4Oc17136814(9713)1810151916(22)21(2015)11124213512h1918H1011H2(H192022)
MFCD16626205
ZINC000040286343
ZINC40286343
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