4-(2-cyanophenyl)sulfonyl-N-cyclohexyl-piperazine-1-carbothioamide

Systemtic Name: 4-(2-cyanophenyl)sulfonyl-N-cyclohexyl-piperazine-1-carbothioamide Openeye Name: 4-(2-cyanophenyl)sulfonyl-N-cyclohexyl-piperazine-1-carbothioamide CAS Name: 4-(2-cyanophenyl)sulfonyl-N-cyclohexyl-1-piperazinecarbothioamide IUPAC Name: 4-(2-cyanophenyl)sulfonyl-N-cyclohexylpiperazine-1-carbothioamide Traditional Name: 4-(2-cyanophenyl)sulfonyl-N-cyclohexyl-piperazine-1-carbothioamide Formula: C18H24N4O2S2 MolecularWeight: 392.53876

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

Isomeric SMILES

C1CCC(CC1)NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C18H24N4O2S2/c19-14-15-6-4-5-9-17(15)26(23,24)22-12-10-21(11-13-22)18(25)20-16-7-2-1-3-8-16/h4-6,9,16H,1-3,7-8,10-13H2,(H,20,25)