2-(3,4-dimethylphenyl)-5-(hydroxymethyl)-N-(3-phenylpropyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 2-(3,4-dimethylphenyl)-5-(hydroxymethyl)-N-(3-phenylpropyl)-1,2,3-triazole-4-carboxamide Openeye Name: 2-(3,4-dimethylphenyl)-5-(hydroxymethyl)-N-(3-phenylpropyl)triazole-4-carboxamide CAS Name: 2-(3,4-dimethylphenyl)-5-(hydroxymethyl)-N-(3-phenylpropyl)-4-triazolecarboxamide IUPAC Name: 2-(3,4-dimethylphenyl)-5-(hydroxymethyl)-N-(3-phenylpropyl)triazole-4-carboxamide Traditional Name: 2-(3,4-dimethylphenyl)-5-methylol-N-(3-phenylpropyl)triazole-4-carboxamide Formula: C21H24N4O2 MolecularWeight: 364.44086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2N=C(C(=N2)C(=O)NCCCC3=CC=CC=C3)CO)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2N=C(C(=N2)C(=O)NCCCC3=CC=CC=C3)CO)C

InChI

InChI=1S/C21H24N4O2/c1-15-10-11-18(13-16(15)2)25-23-19(14-26)20(24-25)21(27)22-12-6-9-17-7-4-3-5-8-17/h3-5,7-8,10-11,13,26H,6,9,12,14H2,1-2H3,(H,22,27)