(3S)-N-butyl-3-(2-methylsulfanylphenyl)carbonyl-piperidine-1-carboxamide

Systemtic Name: (3S)-N-butyl-3-(2-methylsulfanylphenyl)carbonyl-piperidine-1-carboxamide Openeye Name: (3S)-N-butyl-3-(2-methylsulfanylbenzoyl)piperidine-1-carboxamide CAS Name: (3S)-N-butyl-3-[[2-(methylthio)phenyl]-oxomethyl]-1-piperidinecarboxamide IUPAC Name: (3S)-N-butyl-3-(2-methylsulfanylbenzoyl)piperidine-1-carboxamide Traditional Name: (3S)-N-butyl-3-[2-(methylthio)benzoyl]piperidine-1-carboxamide Formula: C18H26N2O2S MolecularWeight: 334.47624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N1CCCC(C1)C(=O)C2=CC=CC=C2SC

Isomeric SMILES

CCCCNC(=O)N1CCC[C@@H](C1)C(=O)C2=CC=CC=C2SC

InChI

InChI=1S/C18H26N2O2S/c1-3-4-11-19-18(22)20-12-7-8-14(13-20)17(21)15-9-5-6-10-16(15)23-2/h5-6,9-10,14H,3-4,7-8,11-13H2,1-2H3,(H,19,22)/t14-/m0/s1