Vitas-M small molecule compound
4-cyanobenzyl 5-amino-2-phenyl-2H-1,2,3-triazole-4-carboxylate
Catalog ID
STK777213
SMILES N#Cc1ccc(cc1)COC(=O)c1nn(nc1N)c1ccccc1
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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 C17H13N5O2 MW 319.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N5O2/c18-10-12-6-8-13(9-7-12)11-24-17(23)15-16(19)21-22(20-15)14-4-2-1-3-5-14/h1-9H,11H2,(H2,19,21)InChIKey
QGAYTFSCIPJAQR-UHFFFAOYSA-NSynonyms
(4CYANOPHENYL)METHYL5AMINO2PHENYLTRIAZOLE4CARBOXYLATE
2H(123)TRIAZOLE4CARBOXYLICACID5AMINO2PHENYL4CYANOBENZYLESTER
4cyanobenzyl5amino2phenyl2H123triazole4carboxylate
C1=CC=C(C=C1)N2N=C(C(=N2)N)C(=O)OCC3=CC=C(C=C3)C#N
InChI=1SC17H13N5O2c1810126813(9712)112417(23)1516(19)2122(2015)144213514h19H11H2(H21921)
MFCD05260167
ZINC000001424647
ZINC01424647
ZINC1424647
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