1-(3,4-dimethylphenyl)sulfonyl-N-(3-phenylsulfanylpropyl)piperidine-4-carboxamide

Systemtic Name: 1-(3,4-dimethylphenyl)sulfonyl-N-(3-phenylsulfanylpropyl)piperidine-4-carboxamide Openeye Name: 1-(3,4-dimethylphenyl)sulfonyl-N-(3-phenylsulfanylpropyl)piperidine-4-carboxamide CAS Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[3-(phenylthio)propyl]-4-piperidinecarboxamide IUPAC Name: 1-(3,4-dimethylphenyl)sulfonyl-N-(3-phenylsulfanylpropyl)piperidine-4-carboxamide Traditional Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[3-(phenylthio)propyl]isonipecotamide Formula: C23H30N2O3S2 MolecularWeight: 446.6259

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCCSC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCCSC3=CC=CC=C3)C

InChI

InChI=1S/C23H30N2O3S2/c1-18-9-10-22(17-19(18)2)30(27,28)25-14-11-20(12-15-25)23(26)24-13-6-16-29-21-7-4-3-5-8-21/h3-5,7-10,17,20H,6,11-16H2,1-2H3,(H,24,26)