4-(4-chlorophenyl)carbonyl-N-propyl-piperidine-1-carbothioamide

Systemtic Name: 4-(4-chlorophenyl)carbonyl-N-propyl-piperidine-1-carbothioamide Openeye Name: 4-(4-chlorobenzoyl)-N-propyl-piperidine-1-carbothioamide CAS Name: 4-[(4-chlorophenyl)-oxomethyl]-N-propyl-1-piperidinecarbothioamide IUPAC Name: 4-(4-chlorobenzoyl)-N-propylpiperidine-1-carbothioamide Traditional Name: 4-(4-chlorobenzoyl)-N-propyl-piperidine-1-carbothioamide Formula: C16H21ClN2OS MolecularWeight: 324.86874

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)N1CCC(CC1)C(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCNC(=S)N1CCC(CC1)C(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H21ClN2OS/c1-2-9-18-16(21)19-10-7-13(8-11-19)15(20)12-3-5-14(17)6-4-12/h3-6,13H,2,7-11H2,1H3,(H,18,21)