4-(2-chlorophenyl)carbonyl-N-propan-2-yl-piperazine-1-carbothioamide

Systemtic Name: 4-(2-chlorophenyl)carbonyl-N-propan-2-yl-piperazine-1-carbothioamide Openeye Name: 4-(2-chlorobenzoyl)-N-isopropyl-piperazine-1-carbothioamide CAS Name: 4-[(2-chlorophenyl)-oxomethyl]-N-propan-2-yl-1-piperazinecarbothioamide IUPAC Name: 4-(2-chlorobenzoyl)-N-propan-2-ylpiperazine-1-carbothioamide Traditional Name: 4-(2-chlorobenzoyl)-N-isopropyl-piperazine-1-carbothioamide Formula: C15H20ClN3OS MolecularWeight: 325.8568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)N1CCN(CC1)C(=O)C2=CC=CC=C2Cl

Isomeric SMILES

CC(C)NC(=S)N1CCN(CC1)C(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C15H20ClN3OS/c1-11(2)17-15(21)19-9-7-18(8-10-19)14(20)12-5-3-4-6-13(12)16/h3-6,11H,7-10H2,1-2H3,(H,17,21)