1-(phenylmethyl)-N-[2-(prop-2-enylcarbamoyl)phenyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(phenylmethyl)-N-[2-(prop-2-enylcarbamoyl)phenyl]-1,2,3-triazole-4-carboxamide Openeye Name: N-[2-(allylcarbamoyl)phenyl]-1-benzyl-triazole-4-carboxamide CAS Name: N-[2-[oxo-(prop-2-enylamino)methyl]phenyl]-1-(phenylmethyl)-4-triazolecarboxamide IUPAC Name: 1-benzyl-N-[2-(prop-2-enylcarbamoyl)phenyl]triazole-4-carboxamide Traditional Name: N-[2-(allylcarbamoyl)phenyl]-1-benzyl-triazole-4-carboxamide Formula: C20H19N5O2 MolecularWeight: 361.39716

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1=CC=CC=C1NC(=O)C2=CN(N=N2)CC3=CC=CC=C3

Isomeric SMILES

C=CCNC(=O)C1=CC=CC=C1NC(=O)C2=CN(N=N2)CC3=CC=CC=C3

InChI

InChI=1S/C20H19N5O2/c1-2-12-21-19(26)16-10-6-7-11-17(16)22-20(27)18-14-25(24-23-18)13-15-8-4-3-5-9-15/h2-11,14H,1,12-13H2,(H,21,26)(H,22,27)