[2-[(2-chlorophenyl)methyl]-1H-imidazol-5-yl] (2Z)-2-(2-thiophen-3-ylethylidene)hexanoate

Systemtic Name: [2-[(2-chlorophenyl)methyl]-1H-imidazol-5-yl] (2Z)-2-(2-thiophen-3-ylethylidene)hexanoate Openeye Name: [2-[(2-chlorophenyl)methyl]-1H-imidazol-5-yl] (2Z)-2-[2-(3-thienyl)ethylidene]hexanoate CAS Name: (2Z)-2-[2-(3-thiophenyl)ethylidene]hexanoic acid [2-[(2-chlorophenyl)methyl]-1H-imidazol-5-yl] ester IUPAC Name: [2-[(2-chlorophenyl)methyl]-1H-imidazol-5-yl] (2Z)-2-(2-thiophen-3-ylethylidene)hexanoate Traditional Name: (Z)-2-butyl-4-(3-thienyl)but-2-enoic acid [2-(2-chlorobenzyl)-1H-imidazol-5-yl] ester Formula: C22H23ClN2O2S MolecularWeight: 414.94822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=CCC1=CSC=C1)C(=O)OC2=CN=C(N2)CC3=CC=CC=C3Cl

Isomeric SMILES

CCCC/C(=C/CC1=CSC=C1)/C(=O)OC2=CN=C(N2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C22H23ClN2O2S/c1-2-3-6-17(10-9-16-11-12-28-15-16)22(26)27-21-14-24-20(25-21)13-18-7-4-5-8-19(18)23/h4-5,7-8,10-12,14-15H,2-3,6,9,13H2,1H3,(H,24,25)/b17-10-