1-cyclopropylcarbonyl-N-[4-(2,5-dimethylphenyl)sulfanylphenyl]piperidine-4-carboxamide

Systemtic Name: 1-cyclopropylcarbonyl-N-[4-(2,5-dimethylphenyl)sulfanylphenyl]piperidine-4-carboxamide Openeye Name: 1-(cyclopropanecarbonyl)-N-[4-(2,5-dimethylphenyl)sulfanylphenyl]piperidine-4-carboxamide CAS Name: 1-[cyclopropyl(oxo)methyl]-N-[4-[(2,5-dimethylphenyl)thio]phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(cyclopropanecarbonyl)-N-[4-(2,5-dimethylphenyl)sulfanylphenyl]piperidine-4-carboxamide Traditional Name: 1-(cyclopropanecarbonyl)-N-[4-[(2,5-dimethylphenyl)thio]phenyl]isonipecotamide Formula: C24H28N2O2S MolecularWeight: 408.55632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SC2=CC=C(C=C2)NC(=O)C3CCN(CC3)C(=O)C4CC4

Isomeric SMILES

CC1=CC(=C(C=C1)C)SC2=CC=C(C=C2)NC(=O)C3CCN(CC3)C(=O)C4CC4

InChI

InChI=1S/C24H28N2O2S/c1-16-3-4-17(2)22(15-16)29-21-9-7-20(8-10-21)25-23(27)18-11-13-26(14-12-18)24(28)19-5-6-19/h3-4,7-10,15,18-19H,5-6,11-14H2,1-2H3,(H,25,27)