1-(1,3-benzodioxol-5-yl)-3-[2-(4-sulfamoylphenyl)ethyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(4-sulfamoylphenyl)ethyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(4-sulfamoylphenyl)ethyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(4-sulfamoylphenyl)ethyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(4-sulfamoylphenyl)ethyl]thiourea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(4-sulfamoylphenyl)ethyl]thiourea Formula: C16H17N3O4S2 MolecularWeight: 379.45388

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=S)NCCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=S)NCCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C16H17N3O4S2/c17-25(20,21)13-4-1-11(2-5-13)7-8-18-16(24)19-12-3-6-14-15(9-12)23-10-22-14/h1-6,9H,7-8,10H2,(H2,17,20,21)(H2,18,19,24)