1-[(4-butylphenyl)carbamothioyl]-N,N-diethyl-piperidine-3-carboxamide

Systemtic Name: 1-[(4-butylphenyl)carbamothioyl]-N,N-diethyl-piperidine-3-carboxamide Openeye Name: 1-[(4-butylphenyl)carbamothioyl]-N,N-diethyl-piperidine-3-carboxamide CAS Name: 1-[(4-butylanilino)-sulfanylidenemethyl]-N,N-diethyl-3-piperidinecarboxamide IUPAC Name: 1-[(4-butylphenyl)carbamothioyl]-N,N-diethylpiperidine-3-carboxamide Traditional Name: 1-[(4-butylphenyl)thiocarbamoyl]-N,N-diethyl-nipecotamide Formula: C21H33N3OS MolecularWeight: 375.57122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H33N3OS/c1-4-7-9-17-11-13-19(14-12-17)22-21(26)24-15-8-10-18(16-24)20(25)23(5-2)6-3/h11-14,18H,4-10,15-16H2,1-3H3,(H,22,26)