1-[(2,4-dichlorophenyl)methylcarbamothioyl]-N,N-diethyl-piperidine-3-carboxamide

Systemtic Name: 1-[(2,4-dichlorophenyl)methylcarbamothioyl]-N,N-diethyl-piperidine-3-carboxamide Openeye Name: 1-[(2,4-dichlorophenyl)methylcarbamothioyl]-N,N-diethyl-piperidine-3-carboxamide CAS Name: 1-[[(2,4-dichlorophenyl)methylamino]-sulfanylidenemethyl]-N,N-diethyl-3-piperidinecarboxamide IUPAC Name: 1-[(2,4-dichlorophenyl)methylcarbamothioyl]-N,N-diethylpiperidine-3-carboxamide Traditional Name: 1-[(2,4-dichlorobenzyl)thiocarbamoyl]-N,N-diethyl-nipecotamide Formula: C18H25Cl2N3OS MolecularWeight: 402.3816

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1CCCN(C1)C(=S)NCC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCN(CC)C(=O)C1CCCN(C1)C(=S)NCC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C18H25Cl2N3OS/c1-3-22(4-2)17(24)14-6-5-9-23(12-14)18(25)21-11-13-7-8-15(19)10-16(13)20/h7-8,10,14H,3-6,9,11-12H2,1-2H3,(H,21,25)