(E)-3-[2-butyl-3-[(2-chlorophenyl)methyl]-1,2-dihydroimidazol-5-yl]-4-thiophen-3-yl-but-2-enoate

Systemtic Name: (E)-3-[2-butyl-3-[(2-chlorophenyl)methyl]-1,2-dihydroimidazol-5-yl]-4-thiophen-3-yl-but-2-enoate Openeye Name: (E)-3-[2-butyl-3-[(2-chlorophenyl)methyl]-1,2-dihydroimidazol-5-yl]-4-(3-thienyl)but-2-enoate CAS Name: (E)-3-[2-butyl-3-[(2-chlorophenyl)methyl]-1,2-dihydroimidazol-5-yl]-4-(3-thiophenyl)-2-butenoate IUPAC Name: (E)-3-[2-butyl-3-[(2-chlorophenyl)methyl]-1,2-dihydroimidazol-5-yl]-4-thiophen-3-ylbut-2-enoate Traditional Name: (E)-3-[2-butyl-1-(2-chlorobenzyl)-4-imidazolin-4-yl]-4-(3-thienyl)but-2-enoate Formula: C22H24ClN2O2S- MolecularWeight: 415.95616

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1NC(=CN1CC2=CC=CC=C2Cl)C(=CC(=O)[O-])CC3=CSC=C3

Isomeric SMILES

CCCCC1NC(=CN1CC2=CC=CC=C2Cl)/C(=C/C(=O)[O-])/CC3=CSC=C3

InChI

InChI=1S/C22H25ClN2O2S/c1-2-3-8-21-24-20(14-25(21)13-17-6-4-5-7-19(17)23)18(12-22(26)27)11-16-9-10-28-15-16/h4-7,9-10,12,14-15,21,24H,2-3,8,11,13H2,1H3,(H,26,27)/p-1/b18-12+