5-azanyl-1-(2-methylphenyl)-N-[(1S)-1-phenylethyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-azanyl-1-(2-methylphenyl)-N-[(1S)-1-phenylethyl]-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-1-(o-tolyl)-N-[(1S)-1-phenylethyl]triazole-4-carboxamide CAS Name: 5-amino-1-(2-methylphenyl)-N-[(1S)-1-phenylethyl]-4-triazolecarboxamide IUPAC Name: 5-amino-1-(2-methylphenyl)-N-[(1S)-1-phenylethyl]triazole-4-carboxamide Traditional Name: 5-amino-1-(o-tolyl)-N-[(1S)-1-phenylethyl]triazole-4-carboxamide Formula: C18H19N5O MolecularWeight: 321.37636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(N=N2)C(=O)NC(C)C3=CC=CC=C3)N

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(N=N2)C(=O)N[C@@H](C)C3=CC=CC=C3)N

InChI

InChI=1S/C18H19N5O/c1-12-8-6-7-11-15(12)23-17(19)16(21-22-23)18(24)20-13(2)14-9-4-3-5-10-14/h3-11,13H,19H2,1-2H3,(H,20,24)/t13-/m0/s1