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

Systemtic Name: 3-(4-chlorophenyl)-1-[5-[(4-dimethylaminophenyl)methylamino]-3-(4-methoxyphenyl)-1,2,4-triazol-1-yl]prop-2-en-1-one Openeye Name: 3-(4-chlorophenyl)-1-[5-[(4-dimethylaminophenyl)methylamino]-3-(4-methoxyphenyl)-1,2,4-triazol-1-yl]prop-2-en-1-one CAS Name: 3-(4-chlorophenyl)-1-[5-[(4-dimethylaminophenyl)methylamino]-3-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-2-propen-1-one IUPAC Name: 3-(4-chlorophenyl)-1-[5-[(4-dimethylaminophenyl)methylamino]-3-(4-methoxyphenyl)-1,2,4-triazol-1-yl]prop-2-en-1-one Traditional Name: 3-(4-chlorophenyl)-1-[5-[[4-(dimethylamino)benzyl]amino]-3-(4-methoxyphenyl)-1,2,4-triazol-1-yl]prop-2-en-1-one Formula: C27H26ClN5O2 MolecularWeight: 487.98064

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CNC2=NC(=NN2C(=O)C=CC3=CC=C(C=C3)Cl)C4=CC=C(C=C4)OC

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNC2=NC(=NN2C(=O)C=CC3=CC=C(C=C3)Cl)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H26ClN5O2/c1-32(2)23-13-6-20(7-14-23)18-29-27-30-26(21-9-15-24(35-3)16-10-21)31-33(27)25(34)17-8-19-4-11-22(28)12-5-19/h4-17H,18H2,1-3H3,(H,29,30,31)