4-(1,3-benzodioxol-5-ylmethyl)-N-[5-(diethylsulfamoyl)-2-methyl-phenyl]piperazine-1-carbothioamide

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethyl)-N-[5-(diethylsulfamoyl)-2-methyl-phenyl]piperazine-1-carbothioamide Openeye Name: 4-(1,3-benzodioxol-5-ylmethyl)-N-[5-(diethylsulfamoyl)-2-methyl-phenyl]piperazine-1-carbothioamide CAS Name: 4-(1,3-benzodioxol-5-ylmethyl)-N-[5-(diethylsulfamoyl)-2-methylphenyl]-1-piperazinecarbothioamide IUPAC Name: 4-(1,3-benzodioxol-5-ylmethyl)-N-[5-(diethylsulfamoyl)-2-methylphenyl]piperazine-1-carbothioamide Traditional Name: N-[5-(diethylsulfamoyl)-2-methyl-phenyl]-4-piperonyl-piperazine-1-carbothioamide Formula: C24H32N4O4S2 MolecularWeight: 504.66528

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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)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)NC(=S)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H32N4O4S2/c1-4-28(5-2)34(29,30)20-8-6-18(3)21(15-20)25-24(33)27-12-10-26(11-13-27)16-19-7-9-22-23(14-19)32-17-31-22/h6-9,14-15H,4-5,10-13,16-17H2,1-3H3,(H,25,33)