1-[(4-butyl-2-methyl-phenyl)carbamothioyl]-N,N-diethyl-piperidine-3-carboxamide

Systemtic Name: 1-[(4-butyl-2-methyl-phenyl)carbamothioyl]-N,N-diethyl-piperidine-3-carboxamide Openeye Name: 1-[(4-butyl-2-methyl-phenyl)carbamothioyl]-N,N-diethyl-piperidine-3-carboxamide CAS Name: 1-[(4-butyl-2-methylanilino)-sulfanylidenemethyl]-N,N-diethyl-3-piperidinecarboxamide IUPAC Name: 1-[(4-butyl-2-methylphenyl)carbamothioyl]-N,N-diethylpiperidine-3-carboxamide Traditional Name: 1-[(4-butyl-2-methyl-phenyl)thiocarbamoyl]-N,N-diethyl-nipecotamide Formula: C22H35N3OS MolecularWeight: 389.5978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)NC(=S)N2CCCC(C2)C(=O)N(CC)CC)C

Isomeric SMILES

CCCCC1=CC(=C(C=C1)NC(=S)N2CCCC(C2)C(=O)N(CC)CC)C

InChI

InChI=1S/C22H35N3OS/c1-5-8-10-18-12-13-20(17(4)15-18)23-22(27)25-14-9-11-19(16-25)21(26)24(6-2)7-3/h12-13,15,19H,5-11,14,16H2,1-4H3,(H,23,27)