(3S)-1-[(2,6-dimethylphenyl)carbamothioyl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-[(2,6-dimethylphenyl)carbamothioyl]piperidine-3-carboxamide Openeye Name: (3S)-1-[(2,6-dimethylphenyl)carbamothioyl]piperidine-3-carboxamide CAS Name: (3S)-1-[(2,6-dimethylanilino)-sulfanylidenemethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-[(2,6-dimethylphenyl)carbamothioyl]piperidine-3-carboxamide Traditional Name: (3S)-1-[(2,6-dimethylphenyl)thiocarbamoyl]nipecotamide Formula: C15H21N3OS MolecularWeight: 291.41174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=S)N2CCCC(C2)C(=O)N

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=S)N2CCC[C@@H](C2)C(=O)N

InChI

InChI=1S/C15H21N3OS/c1-10-5-3-6-11(2)13(10)17-15(20)18-8-4-7-12(9-18)14(16)19/h3,5-6,12H,4,7-9H2,1-2H3,(H2,16,19)(H,17,20)/t12-/m0/s1