4-(3-chlorophenyl)-N-decyl-piperazine-1-carbothioamide

Systemtic Name: 4-(3-chlorophenyl)-N-decyl-piperazine-1-carbothioamide Openeye Name: 4-(3-chlorophenyl)-N-decyl-piperazine-1-carbothioamide CAS Name: 4-(3-chlorophenyl)-N-decyl-1-piperazinecarbothioamide IUPAC Name: 4-(3-chlorophenyl)-N-decylpiperazine-1-carbothioamide Traditional Name: 4-(3-chlorophenyl)-N-decyl-piperazine-1-carbothioamide Formula: C21H34ClN3S MolecularWeight: 396.03276

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCNC(=S)N1CCN(CC1)C2=CC(=CC=C2)Cl

Isomeric SMILES

CCCCCCCCCCNC(=S)N1CCN(CC1)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C21H34ClN3S/c1-2-3-4-5-6-7-8-9-13-23-21(26)25-16-14-24(15-17-25)20-12-10-11-19(22)18-20/h10-12,18H,2-9,13-17H2,1H3,(H,23,26)