[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl] (E)-2-(thiophen-2-ylmethyl)hept-2-enoate

Systemtic Name: [2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl] (E)-2-(thiophen-2-ylmethyl)hept-2-enoate Openeye Name: [2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl] (E)-2-(2-thienylmethyl)hept-2-enoate CAS Name: (E)-2-(thiophen-2-ylmethyl)-2-heptenoic acid [2-butyl-3-[(2-chlorophenyl)methyl]-4-imidazolyl] ester IUPAC Name: [2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl] (E)-2-(thiophen-2-ylmethyl)hept-2-enoate Traditional Name: (E)-2-(2-thenyl)hept-2-enoic acid [2-butyl-3-(2-chlorobenzyl)imidazol-4-yl] ester Formula: C26H31ClN2O2S MolecularWeight: 471.05454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=C(CC1=CC=CS1)C(=O)OC2=CN=C(N2CC3=CC=CC=C3Cl)CCCC

Isomeric SMILES

CCCC/C=C(\CC1=CC=CS1)/C(=O)OC2=CN=C(N2CC3=CC=CC=C3Cl)CCCC

InChI

InChI=1S/C26H31ClN2O2S/c1-3-5-7-11-20(17-22-13-10-16-32-22)26(30)31-25-18-28-24(15-6-4-2)29(25)19-21-12-8-9-14-23(21)27/h8-14,16,18H,3-7,15,17,19H2,1-2H3/b20-11+