1-(4-chlorophenyl)-N-[[1-(1,4-dithiepan-6-yl)piperidin-3-yl]methyl]cyclopropane-1-carboxamide

Systemtic Name: 1-(4-chlorophenyl)-N-[[1-(1,4-dithiepan-6-yl)piperidin-3-yl]methyl]cyclopropane-1-carboxamide Openeye Name: 1-(4-chlorophenyl)-N-[[1-(1,4-dithiepan-6-yl)-3-piperidyl]methyl]cyclopropanecarboxamide CAS Name: 1-(4-chlorophenyl)-N-[[1-(1,4-dithiepan-6-yl)-3-piperidinyl]methyl]-1-cyclopropanecarboxamide IUPAC Name: 1-(4-chlorophenyl)-N-[[1-(1,4-dithiepan-6-yl)piperidin-3-yl]methyl]cyclopropane-1-carboxamide Traditional Name: 1-(4-chlorophenyl)-N-[[1-(1,4-dithiepan-6-yl)-3-piperidyl]methyl]cyclopropanecarboxamide Formula: C21H29ClN2OS2 MolecularWeight: 425.05076

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2CSCCSC2)CNC(=O)C3(CC3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CC(CN(C1)C2CSCCSC2)CNC(=O)C3(CC3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H29ClN2OS2/c22-18-5-3-17(4-6-18)21(7-8-21)20(25)23-12-16-2-1-9-24(13-16)19-14-26-10-11-27-15-19/h3-6,16,19H,1-2,7-15H2,(H,23,25)