1-(1,3-benzodioxol-5-ylmethyl)-3-[[2-(thiophen-2-ylsulfonylamino)phenyl]carbonylamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[2-(thiophen-2-ylsulfonylamino)phenyl]carbonylamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[2-(2-thienylsulfonylamino)benzoyl]amino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[oxo-[2-(thiophen-2-ylsulfonylamino)phenyl]methyl]amino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[2-(thiophen-2-ylsulfonylamino)benzoyl]amino]thiourea Traditional Name: 1-piperonyl-3-[[2-(2-thienylsulfonylamino)benzoyl]amino]thiourea Formula: C20H18N4O5S3 MolecularWeight: 490.57572

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=S)NNC(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=S)NNC(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C20H18N4O5S3/c25-19(14-4-1-2-5-15(14)24-32(26,27)18-6-3-9-31-18)22-23-20(30)21-11-13-7-8-16-17(10-13)29-12-28-16/h1-10,24H,11-12H2,(H,22,25)(H2,21,23,30)