(E)-7-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]hept-2-enoate

Systemtic Name: (E)-7-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]hept-2-enoate Openeye Name: (E)-7-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]hept-2-enoate CAS Name: (E)-7-[(4,5-diphenyl-1H-imidazol-2-yl)thio]-2-heptenoate IUPAC Name: (E)-7-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]hept-2-enoate Traditional Name: (E)-7-[(4,5-diphenyl-1H-imidazol-2-yl)thio]hept-2-enoate Formula: C22H21N2O2S- MolecularWeight: 377.47934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=C(N2)SCCCCC=CC(=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=C(N2)SCCCC/C=C/C(=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C22H22N2O2S/c25-19(26)15-9-1-2-10-16-27-22-23-20(17-11-5-3-6-12-17)21(24-22)18-13-7-4-8-14-18/h3-9,11-15H,1-2,10,16H2,(H,23,24)(H,25,26)/p-1/b15-9+