(3R)-N-(2-chloranyl-4,6-dimethyl-phenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide

Systemtic Name: (3R)-N-(2-chloranyl-4,6-dimethyl-phenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide Openeye Name: (3R)-N-(2-chloro-4,6-dimethyl-phenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide CAS Name: (3R)-N-(2-chloro-4,6-dimethylphenyl)-3-(hydroxymethyl)-1-piperidinecarbothioamide IUPAC Name: (3R)-N-(2-chloro-4,6-dimethylphenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide Traditional Name: (3R)-N-(2-chloro-4,6-dimethyl-phenyl)-3-methylol-piperidine-1-carbothioamide Formula: C15H21ClN2OS MolecularWeight: 312.85804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21ClN2OS/c1-10-6-11(2)14(13(16)7-10)17-15(20)18-5-3-4-12(8-18)9-19/h6-7,12,19H,3-5,8-9H2,1-2H3,(H,17,20)/t12-/m1/s1