N-(4-butylphenyl)-3,5-dimethyl-piperidine-1-carbothioamide

Systemtic Name: N-(4-butylphenyl)-3,5-dimethyl-piperidine-1-carbothioamide Openeye Name: N-(4-butylphenyl)-3,5-dimethyl-piperidine-1-carbothioamide CAS Name: N-(4-butylphenyl)-3,5-dimethyl-1-piperidinecarbothioamide IUPAC Name: N-(4-butylphenyl)-3,5-dimethylpiperidine-1-carbothioamide Traditional Name: N-(4-butylphenyl)-3,5-dimethyl-piperidine-1-carbothioamide Formula: C18H28N2S MolecularWeight: 304.49332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)N2CC(CC(C2)C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)N2CC(CC(C2)C)C

InChI

InChI=1S/C18H28N2S/c1-4-5-6-16-7-9-17(10-8-16)19-18(21)20-12-14(2)11-15(3)13-20/h7-10,14-15H,4-6,11-13H2,1-3H3,(H,19,21)