1-phenyl-3-[3-(4-sulfamoylphenyl)propanoylamino]thiourea

Systemtic Name: 1-phenyl-3-[3-(4-sulfamoylphenyl)propanoylamino]thiourea Openeye Name: 1-phenyl-3-[3-(4-sulfamoylphenyl)propanoylamino]thiourea CAS Name: 1-[[1-oxo-3-(4-sulfamoylphenyl)propyl]amino]-3-phenylthiourea IUPAC Name: 1-phenyl-3-[3-(4-sulfamoylphenyl)propanoylamino]thiourea Traditional Name: 1-phenyl-3-[3-(4-sulfamoylphenyl)propanoylamino]thiourea Formula: C16H18N4O3S2 MolecularWeight: 378.46912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NNC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NNC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C16H18N4O3S2/c17-25(22,23)14-9-6-12(7-10-14)8-11-15(21)19-20-16(24)18-13-4-2-1-3-5-13/h1-7,9-10H,8,11H2,(H,19,21)(H2,17,22,23)(H2,18,20,24)