N-(3-chloranyl-4-methyl-phenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide CAS Name: N-(3-chloro-4-methylphenyl)-3-(hydroxymethyl)-1-piperidinecarbothioamide IUPAC Name: N-(3-chloro-4-methylphenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-3-methylol-piperidine-1-carbothioamide Formula: C14H19ClN2OS MolecularWeight: 298.83146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19ClN2OS/c1-10-4-5-12(7-13(10)15)16-14(19)17-6-2-3-11(8-17)9-18/h4-5,7,11,18H,2-3,6,8-9H2,1H3,(H,16,19)