N-(3-imidazol-1-ylpropyl)-1-(3-methylphenyl)-5-phenyl-1,2,4-triazole-3-carboxamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-1-(3-methylphenyl)-5-phenyl-1,2,4-triazole-3-carboxamide Openeye Name: N-(3-imidazol-1-ylpropyl)-1-(m-tolyl)-5-phenyl-1,2,4-triazole-3-carboxamide CAS Name: N-[3-(1-imidazolyl)propyl]-1-(3-methylphenyl)-5-phenyl-1,2,4-triazole-3-carboxamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-1-(3-methylphenyl)-5-phenyl-1,2,4-triazole-3-carboxamide Traditional Name: N-(3-imidazol-1-ylpropyl)-1-(m-tolyl)-5-phenyl-1,2,4-triazole-3-carboxamide Formula: C22H22N6O MolecularWeight: 386.44968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NC(=N2)C(=O)NCCCN3C=CN=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NC(=N2)C(=O)NCCCN3C=CN=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H22N6O/c1-17-7-5-10-19(15-17)28-21(18-8-3-2-4-9-18)25-20(26-28)22(29)24-11-6-13-27-14-12-23-16-27/h2-5,7-10,12,14-16H,6,11,13H2,1H3,(H,24,29)