(2-methylphenyl)-[5-[(4-propan-2-ylphenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]methanone

Systemtic Name: (2-methylphenyl)-[5-[(4-propan-2-ylphenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]methanone Openeye Name: [5-[(4-isopropylphenyl)methylamino]-3-(3-pyridyl)-1,2,4-triazol-1-yl]-(o-tolyl)methanone CAS Name: (2-methylphenyl)-[5-[(4-propan-2-ylphenyl)methylamino]-3-(3-pyridinyl)-1,2,4-triazol-1-yl]methanone IUPAC Name: (2-methylphenyl)-[5-[(4-propan-2-ylphenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]methanone Traditional Name: [5-[(4-isopropylbenzyl)amino]-3-(3-pyridyl)-1,2,4-triazol-1-yl]-(o-tolyl)methanone Formula: C25H25N5O MolecularWeight: 411.4989

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2C(=NC(=N2)C3=CN=CC=C3)NCC4=CC=C(C=C4)C(C)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2C(=NC(=N2)C3=CN=CC=C3)NCC4=CC=C(C=C4)C(C)C

InChI

InChI=1S/C25H25N5O/c1-17(2)20-12-10-19(11-13-20)15-27-25-28-23(21-8-6-14-26-16-21)29-30(25)24(31)22-9-5-4-7-18(22)3/h4-14,16-17H,15H2,1-3H3,(H,27,28,29)