Vitas-M small molecule compound
2-benzyl-5-[(phenylamino)methyl]-1,2-dihydro-3H-1,2,4-triazol-3-one
Catalog ID
STK937141
SMILES O=c1nc([nH]n1Cc1ccccc1)CNc1ccccc1
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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 C16H16N4O MW 280.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O/c21-16-18-15(11-17-14-9-5-2-6-10-14)19-20(16)12-13-7-3-1-4-8-13/h1-10,17H,11-12H2,(H,18,19,21)InChIKey
UJJOXCRFALJCPZ-UHFFFAOYSA-NSynonyms
1219574-70-51219574705
2benzyl5((phenylamino)methyl)12dihydro3H124triazol3one
2benzyl5((phenylamino)methyl)1H124triazol3(2H)one
5(anilinomethyl)2benzyl1H124triazol3one
C1=CC=C(C=C1)CN2C(=O)N=C(N2)CNC3=CC=CC=C3
InChI=1SC16H16N4Oc21161815(11171495261014)1920(16)12137314813h11017H1112H2(H181921)
MFCD16623350
O=c1nc((nH)n1Cc1ccccc1)CNc1ccccc1
ZINC000040266760
ZINC40266760
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