(3S)-1-[2-[1-(3-chlorophenyl)-5-phenyl-imidazol-2-yl]sulfanylethanoyl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-[2-[1-(3-chlorophenyl)-5-phenyl-imidazol-2-yl]sulfanylethanoyl]piperidine-3-carboxamide Openeye Name: (3S)-1-[2-[1-(3-chlorophenyl)-5-phenyl-imidazol-2-yl]sulfanylacetyl]piperidine-3-carboxamide CAS Name: (3S)-1-[2-[[1-(3-chlorophenyl)-5-phenyl-2-imidazolyl]thio]-1-oxoethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-[2-[1-(3-chlorophenyl)-5-phenylimidazol-2-yl]sulfanylacetyl]piperidine-3-carboxamide Traditional Name: (3S)-1-[2-[[1-(3-chlorophenyl)-5-phenyl-imidazol-2-yl]thio]acetyl]nipecotamide Formula: C23H23ClN4O2S MolecularWeight: 454.97232

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CSC2=NC=C(N2C3=CC(=CC=C3)Cl)C4=CC=CC=C4)C(=O)N

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)CSC2=NC=C(N2C3=CC(=CC=C3)Cl)C4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C23H23ClN4O2S/c24-18-9-4-10-19(12-18)28-20(16-6-2-1-3-7-16)13-26-23(28)31-15-21(29)27-11-5-8-17(14-27)22(25)30/h1-4,6-7,9-10,12-13,17H,5,8,11,14-15H2,(H2,25,30)/t17-/m0/s1