1-[5-[(4-chlorophenyl)methylamino]-3-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-3-(2-methoxyphenyl)prop-2-en-1-one

Systemtic Name: 1-[5-[(4-chlorophenyl)methylamino]-3-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-3-(2-methoxyphenyl)prop-2-en-1-one Openeye Name: 1-[5-[(4-chlorophenyl)methylamino]-3-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-3-(2-methoxyphenyl)prop-2-en-1-one CAS Name: 1-[5-[(4-chlorophenyl)methylamino]-3-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-3-(2-methoxyphenyl)-2-propen-1-one IUPAC Name: 1-[5-[(4-chlorophenyl)methylamino]-3-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-3-(2-methoxyphenyl)prop-2-en-1-one Traditional Name: 1-[5-[(4-chlorobenzyl)amino]-3-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-3-(2-methoxyphenyl)prop-2-en-1-one Formula: C26H23ClN4O3 MolecularWeight: 474.93882

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=C(C=C3)Cl)C(=O)C=CC4=CC=CC=C4OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=C(C=C3)Cl)C(=O)C=CC4=CC=CC=C4OC

InChI

InChI=1S/C26H23ClN4O3/c1-33-22-14-9-20(10-15-22)25-29-26(28-17-18-7-12-21(27)13-8-18)31(30-25)24(32)16-11-19-5-3-4-6-23(19)34-2/h3-16H,17H2,1-2H3,(H,28,29,30)