N-[5-(diethylsulfamoyl)-2-methyl-phenyl]-4-ethanoyl-piperazine-1-carbothioamide

Systemtic Name: N-[5-(diethylsulfamoyl)-2-methyl-phenyl]-4-ethanoyl-piperazine-1-carbothioamide Openeye Name: 4-acetyl-N-[5-(diethylsulfamoyl)-2-methyl-phenyl]piperazine-1-carbothioamide CAS Name: 4-acetyl-N-[5-(diethylsulfamoyl)-2-methylphenyl]-1-piperazinecarbothioamide IUPAC Name: 4-acetyl-N-[5-(diethylsulfamoyl)-2-methylphenyl]piperazine-1-carbothioamide Traditional Name: 4-acetyl-N-[5-(diethylsulfamoyl)-2-methyl-phenyl]piperazine-1-carbothioamide Formula: C18H28N4O3S2 MolecularWeight: 412.56992

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)NC(=S)N2CCN(CC2)C(=O)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)NC(=S)N2CCN(CC2)C(=O)C

InChI

InChI=1S/C18H28N4O3S2/c1-5-22(6-2)27(24,25)16-8-7-14(3)17(13-16)19-18(26)21-11-9-20(10-12-21)15(4)23/h7-8,13H,5-6,9-12H2,1-4H3,(H,19,26)