(3R)-1-[(2-chloranyl-4,6-dimethyl-phenyl)carbamothioyl]piperidine-3-carboxamide

Systemtic Name: (3R)-1-[(2-chloranyl-4,6-dimethyl-phenyl)carbamothioyl]piperidine-3-carboxamide Openeye Name: (3R)-1-[(2-chloro-4,6-dimethyl-phenyl)carbamothioyl]piperidine-3-carboxamide CAS Name: (3R)-1-[(2-chloro-4,6-dimethylanilino)-sulfanylidenemethyl]-3-piperidinecarboxamide IUPAC Name: (3R)-1-[(2-chloro-4,6-dimethylphenyl)carbamothioyl]piperidine-3-carboxamide Traditional Name: (3R)-1-[(2-chloro-4,6-dimethyl-phenyl)thiocarbamoyl]nipecotamide Formula: C15H20ClN3OS MolecularWeight: 325.8568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20ClN3OS/c1-9-6-10(2)13(12(16)7-9)18-15(21)19-5-3-4-11(8-19)14(17)20/h6-7,11H,3-5,8H2,1-2H3,(H2,17,20)(H,18,21)/t11-/m1/s1