1-[(2,4-dimethylphenyl)carbamothioyl]piperidine-3-carboxamide

Systemtic Name: 1-[(2,4-dimethylphenyl)carbamothioyl]piperidine-3-carboxamide Openeye Name: 1-[(2,4-dimethylphenyl)carbamothioyl]piperidine-3-carboxamide CAS Name: 1-[(2,4-dimethylanilino)-sulfanylidenemethyl]-3-piperidinecarboxamide IUPAC Name: 1-[(2,4-dimethylphenyl)carbamothioyl]piperidine-3-carboxamide Traditional Name: 1-[(2,4-dimethylphenyl)thiocarbamoyl]nipecotamide Formula: C15H21N3OS MolecularWeight: 291.41174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N3OS/c1-10-5-6-13(11(2)8-10)17-15(20)18-7-3-4-12(9-18)14(16)19/h5-6,8,12H,3-4,7,9H2,1-2H3,(H2,16,19)(H,17,20)