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

Systemtic Name: 1-[5-[(4-chlorophenyl)methylamino]-3-(4-methylphenyl)-1,2,4-triazol-1-yl]-3-(4-methoxyphenyl)prop-2-en-1-one Openeye Name: 1-[5-[(4-chlorophenyl)methylamino]-3-(p-tolyl)-1,2,4-triazol-1-yl]-3-(4-methoxyphenyl)prop-2-en-1-one CAS Name: 1-[5-[(4-chlorophenyl)methylamino]-3-(4-methylphenyl)-1,2,4-triazol-1-yl]-3-(4-methoxyphenyl)-2-propen-1-one IUPAC Name: 1-[5-[(4-chlorophenyl)methylamino]-3-(4-methylphenyl)-1,2,4-triazol-1-yl]-3-(4-methoxyphenyl)prop-2-en-1-one Traditional Name: 1-[5-[(4-chlorobenzyl)amino]-3-(p-tolyl)-1,2,4-triazol-1-yl]-3-(4-methoxyphenyl)prop-2-en-1-one Formula: C26H23ClN4O2 MolecularWeight: 458.93942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=C(C=C3)Cl)C(=O)C=CC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=C(C=C3)Cl)C(=O)C=CC4=CC=C(C=C4)OC

InChI

InChI=1S/C26H23ClN4O2/c1-18-3-10-21(11-4-18)25-29-26(28-17-20-5-12-22(27)13-6-20)31(30-25)24(32)16-9-19-7-14-23(33-2)15-8-19/h3-16H,17H2,1-2H3,(H,28,29,30)