[5-[(4-chlorophenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-cyclopropyl-methanone

Systemtic Name: [5-[(4-chlorophenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-cyclopropyl-methanone Openeye Name: [5-[(4-chlorophenyl)methylamino]-3-(3-pyridyl)-1,2,4-triazol-1-yl]-cyclopropyl-methanone CAS Name: [5-[(4-chlorophenyl)methylamino]-3-(3-pyridinyl)-1,2,4-triazol-1-yl]-cyclopropylmethanone IUPAC Name: [5-[(4-chlorophenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-cyclopropylmethanone Traditional Name: [5-[(4-chlorobenzyl)amino]-3-(3-pyridyl)-1,2,4-triazol-1-yl]-cyclopropyl-methanone Formula: C18H16ClN5O MolecularWeight: 353.80554

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2C(=NC(=N2)C3=CN=CC=C3)NCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CC1C(=O)N2C(=NC(=N2)C3=CN=CC=C3)NCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C18H16ClN5O/c19-15-7-3-12(4-8-15)10-21-18-22-16(14-2-1-9-20-11-14)23-24(18)17(25)13-5-6-13/h1-4,7-9,11,13H,5-6,10H2,(H,21,22,23)