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

Systemtic Name: N-cyclohexyl-4-(2-nitrophenyl)sulfonyl-piperazine-1-carbothioamide Openeye Name: N-cyclohexyl-4-(2-nitrophenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: N-cyclohexyl-4-(2-nitrophenyl)sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-cyclohexyl-4-(2-nitrophenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: N-cyclohexyl-4-(2-nitrophenyl)sulfonyl-piperazine-1-carbothioamide Formula: C17H24N4O4S2 MolecularWeight: 412.52686

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C17H24N4O4S2/c22-21(23)15-8-4-5-9-16(15)27(24,25)20-12-10-19(11-13-20)17(26)18-14-6-2-1-3-7-14/h4-5,8-9,14H,1-3,6-7,10-13H2,(H,18,26)