N-[4-[[4-[(1,3-benzodioxol-5-ylmethylcarbamothioylamino)carbamoyl]phenyl]methylsulfamoyl]phenyl]ethanamide

Systemtic Name: N-[4-[[4-[(1,3-benzodioxol-5-ylmethylcarbamothioylamino)carbamoyl]phenyl]methylsulfamoyl]phenyl]ethanamide Openeye Name: N-[4-[[4-[(1,3-benzodioxol-5-ylmethylcarbamothioylamino)carbamoyl]phenyl]methylsulfamoyl]phenyl]acetamide CAS Name: N-[4-[[4-[[[(1,3-benzodioxol-5-ylmethylamino)-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]methylsulfamoyl]phenyl]acetamide IUPAC Name: N-[4-[[4-[(1,3-benzodioxol-5-ylmethylcarbamothioylamino)carbamoyl]phenyl]methylsulfamoyl]phenyl]acetamide Traditional Name: N-[4-[[4-[(piperonylthiocarbamoylamino)carbamoyl]benzyl]sulfamoyl]phenyl]acetamide Formula: C25H25N5O6S2 MolecularWeight: 555.6259

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)NNC(=S)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)NNC(=S)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C25H25N5O6S2/c1-16(31)28-20-7-9-21(10-8-20)38(33,34)27-14-17-2-5-19(6-3-17)24(32)29-30-25(37)26-13-18-4-11-22-23(12-18)36-15-35-22/h2-12,27H,13-15H2,1H3,(H,28,31)(H,29,32)(H2,26,30,37)