N-(3,4-dimethylphenyl)-1-[2-oxidanylidene-2-(2-phenylpropylamino)ethyl]-1,2,4-triazole-3-carboxamide

Systemtic Name: N-(3,4-dimethylphenyl)-1-[2-oxidanylidene-2-(2-phenylpropylamino)ethyl]-1,2,4-triazole-3-carboxamide Openeye Name: N-(3,4-dimethylphenyl)-1-[2-oxo-2-(2-phenylpropylamino)ethyl]-1,2,4-triazole-3-carboxamide CAS Name: N-(3,4-dimethylphenyl)-1-[2-oxo-2-(2-phenylpropylamino)ethyl]-1,2,4-triazole-3-carboxamide IUPAC Name: N-(3,4-dimethylphenyl)-1-[2-oxo-2-(2-phenylpropylamino)ethyl]-1,2,4-triazole-3-carboxamide Traditional Name: N-(3,4-dimethylphenyl)-1-[2-keto-2-(2-phenylpropylamino)ethyl]-1,2,4-triazole-3-carboxamide Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=NN(C=N2)CC(=O)NCC(C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=NN(C=N2)CC(=O)NCC(C)C3=CC=CC=C3)C

InChI

InChI=1S/C22H25N5O2/c1-15-9-10-19(11-16(15)2)25-22(29)21-24-14-27(26-21)13-20(28)23-12-17(3)18-7-5-4-6-8-18/h4-11,14,17H,12-13H2,1-3H3,(H,23,28)(H,25,29)