3,4-bis(chloranyl)-N-[3-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanylpropyl]benzamide

Systemtic Name: 3,4-bis(chloranyl)-N-[3-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanylpropyl]benzamide Openeye Name: 3,4-dichloro-N-[3-(1-ethyl-4,5-diphenyl-imidazol-2-yl)sulfanylpropyl]benzamide CAS Name: 3,4-dichloro-N-[3-[(1-ethyl-4,5-diphenyl-2-imidazolyl)thio]propyl]benzamide IUPAC Name: 3,4-dichloro-N-[3-(1-ethyl-4,5-diphenylimidazol-2-yl)sulfanylpropyl]benzamide Traditional Name: 3,4-dichloro-N-[3-[(1-ethyl-4,5-diphenyl-imidazol-2-yl)thio]propyl]benzamide Formula: C27H25Cl2N3OS MolecularWeight: 510.4779

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(N=C1SCCCNC(=O)C2=CC(=C(C=C2)Cl)Cl)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=C(N=C1SCCCNC(=O)C2=CC(=C(C=C2)Cl)Cl)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H25Cl2N3OS/c1-2-32-25(20-12-7-4-8-13-20)24(19-10-5-3-6-11-19)31-27(32)34-17-9-16-30-26(33)21-14-15-22(28)23(29)18-21/h3-8,10-15,18H,2,9,16-17H2,1H3,(H,30,33)