4-(4-ethanoylphenyl)-N-[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]piperazine-1-carbothioamide

Systemtic Name: 4-(4-ethanoylphenyl)-N-[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]piperazine-1-carbothioamide Openeye Name: 4-(4-acetylphenyl)-N-[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]piperazine-1-carbothioamide CAS Name: 4-(4-acetylphenyl)-N-[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]-1-piperazinecarbothioamide IUPAC Name: 4-(4-acetylphenyl)-N-[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]piperazine-1-carbothioamide Traditional Name: 4-(4-acetylphenyl)-N-[4-(p-phenetylsulfamoyl)phenyl]piperazine-1-carbothioamide Formula: C27H30N4O4S2 MolecularWeight: 538.6815

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)N3CCN(CC3)C4=CC=C(C=C4)C(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)N3CCN(CC3)C4=CC=C(C=C4)C(=O)C

InChI

InChI=1S/C27H30N4O4S2/c1-3-35-25-12-6-23(7-13-25)29-37(33,34)26-14-8-22(9-15-26)28-27(36)31-18-16-30(17-19-31)24-10-4-21(5-11-24)20(2)32/h4-15,29H,3,16-19H2,1-2H3,(H,28,36)