1-(1,3-benzodioxol-5-yl)-3-[4-[(phenylmethyl)sulfamoyl]phenyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[4-[(phenylmethyl)sulfamoyl]phenyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[4-(benzylsulfamoyl)phenyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[4-[(phenylmethyl)sulfamoyl]phenyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[4-(benzylsulfamoyl)phenyl]thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[4-(benzylsulfamoyl)phenyl]thiourea Formula: C21H19N3O4S2 MolecularWeight: 441.52326

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C21H19N3O4S2/c25-30(26,22-13-15-4-2-1-3-5-15)18-9-6-16(7-10-18)23-21(29)24-17-8-11-19-20(12-17)28-14-27-19/h1-12,22H,13-14H2,(H2,23,24,29)