N-(4-chloranyl-2,5-dimethoxy-phenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide Openeye Name: N-(4-chloro-2,5-dimethoxy-phenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-3-(hydroxymethyl)-1-piperidinecarbothioamide IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide Traditional Name: N-(4-chloro-2,5-dimethoxy-phenyl)-3-methylol-piperidine-1-carbothioamide Formula: C15H21ClN2O3S MolecularWeight: 344.85684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=S)N2CCCC(C2)CO)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=S)N2CCCC(C2)CO)OC)Cl

InChI

InChI=1S/C15H21ClN2O3S/c1-20-13-7-12(14(21-2)6-11(13)16)17-15(22)18-5-3-4-10(8-18)9-19/h6-7,10,19H,3-5,8-9H2,1-2H3,(H,17,22)