1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-2-(1-phenethylbenzimidazol-2-yl)sulfanyl-ethanone

Systemtic Name: 1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-2-(1-phenethylbenzimidazol-2-yl)sulfanyl-ethanone Openeye Name: 1-[(3S,5S)-3,5-dimethyl-1-piperidyl]-2-(1-phenethylbenzimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-[(3S,5S)-3,5-dimethyl-1-piperidinyl]-2-[(1-phenethyl-2-benzimidazolyl)thio]ethanone IUPAC Name: 1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-2-(1-phenethylbenzimidazol-2-yl)sulfanylethanone Traditional Name: 1-[(3S,5S)-3,5-dimethylpiperidino]-2-[(1-phenethylbenzimidazol-2-yl)thio]ethanone Formula: C24H29N3OS MolecularWeight: 407.57156

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CSC2=NC3=CC=CC=C3N2CCC4=CC=CC=C4)C

Isomeric SMILES

C[C@H]1C[C@@H](CN(C1)C(=O)CSC2=NC3=CC=CC=C3N2CCC4=CC=CC=C4)C

InChI

InChI=1S/C24H29N3OS/c1-18-14-19(2)16-26(15-18)23(28)17-29-24-25-21-10-6-7-11-22(21)27(24)13-12-20-8-4-3-5-9-20/h3-11,18-19H,12-17H2,1-2H3/t18-,19-/m0/s1