1-[5-[(4-chlorophenyl)methylamino]-3-phenyl-1,2,4-triazol-1-yl]-2-methoxy-ethanone

Systemtic Name: 1-[5-[(4-chlorophenyl)methylamino]-3-phenyl-1,2,4-triazol-1-yl]-2-methoxy-ethanone Openeye Name: 1-[5-[(4-chlorophenyl)methylamino]-3-phenyl-1,2,4-triazol-1-yl]-2-methoxy-ethanone CAS Name: 1-[5-[(4-chlorophenyl)methylamino]-3-phenyl-1,2,4-triazol-1-yl]-2-methoxyethanone IUPAC Name: 1-[5-[(4-chlorophenyl)methylamino]-3-phenyl-1,2,4-triazol-1-yl]-2-methoxyethanone Traditional Name: 1-[5-[(4-chlorobenzyl)amino]-3-phenyl-1,2,4-triazol-1-yl]-2-methoxy-ethanone Formula: C18H17ClN4O2 MolecularWeight: 356.80618

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)N1C(=NC(=N1)C2=CC=CC=C2)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

COCC(=O)N1C(=NC(=N1)C2=CC=CC=C2)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H17ClN4O2/c1-25-12-16(24)23-18(20-11-13-7-9-15(19)10-8-13)21-17(22-23)14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,20,21,22)