4-(2-chlorophenyl)-N-hexyl-piperazine-1-carbothioamide

Systemtic Name: 4-(2-chlorophenyl)-N-hexyl-piperazine-1-carbothioamide Openeye Name: 4-(2-chlorophenyl)-N-hexyl-piperazine-1-carbothioamide CAS Name: 4-(2-chlorophenyl)-N-hexyl-1-piperazinecarbothioamide IUPAC Name: 4-(2-chlorophenyl)-N-hexylpiperazine-1-carbothioamide Traditional Name: 4-(2-chlorophenyl)-N-hexyl-piperazine-1-carbothioamide Formula: C17H26ClN3S MolecularWeight: 339.92644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=S)N1CCN(CC1)C2=CC=CC=C2Cl

Isomeric SMILES

CCCCCCNC(=S)N1CCN(CC1)C2=CC=CC=C2Cl

InChI

InChI=1S/C17H26ClN3S/c1-2-3-4-7-10-19-17(22)21-13-11-20(12-14-21)16-9-6-5-8-15(16)18/h5-6,8-9H,2-4,7,10-14H2,1H3,(H,19,22)