N-tert-butyl-4-(4-chlorophenyl)carbonyl-piperidine-1-carbothioamide

Systemtic Name: N-tert-butyl-4-(4-chlorophenyl)carbonyl-piperidine-1-carbothioamide Openeye Name: N-tert-butyl-4-(4-chlorobenzoyl)piperidine-1-carbothioamide CAS Name: N-tert-butyl-4-[(4-chlorophenyl)-oxomethyl]-1-piperidinecarbothioamide IUPAC Name: N-tert-butyl-4-(4-chlorobenzoyl)piperidine-1-carbothioamide Traditional Name: N-tert-butyl-4-(4-chlorobenzoyl)piperidine-1-carbothioamide Formula: C17H23ClN2OS MolecularWeight: 338.89532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23ClN2OS/c1-17(2,3)19-16(22)20-10-8-13(9-11-20)15(21)12-4-6-14(18)7-5-12/h4-7,13H,8-11H2,1-3H3,(H,19,22)