1-[2-(dimethylamino)-5-sulfamoyl-phenyl]-3-(3-fluoranyl-4-methyl-phenyl)thiourea

Systemtic Name: 1-[2-(dimethylamino)-5-sulfamoyl-phenyl]-3-(3-fluoranyl-4-methyl-phenyl)thiourea Openeye Name: 1-[2-(dimethylamino)-5-sulfamoyl-phenyl]-3-(3-fluoro-4-methyl-phenyl)thiourea CAS Name: 1-[2-(dimethylamino)-5-sulfamoylphenyl]-3-(3-fluoro-4-methylphenyl)thiourea IUPAC Name: 1-[2-(dimethylamino)-5-sulfamoylphenyl]-3-(3-fluoro-4-methylphenyl)thiourea Traditional Name: 1-[2-(dimethylamino)-5-sulfamoyl-phenyl]-3-(3-fluoro-4-methyl-phenyl)thiourea Formula: C16H19FN4O2S2 MolecularWeight: 382.476063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC2=C(C=CC(=C2)S(=O)(=O)N)N(C)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC2=C(C=CC(=C2)S(=O)(=O)N)N(C)C)F

InChI

InChI=1S/C16H19FN4O2S2/c1-10-4-5-11(8-13(10)17)19-16(24)20-14-9-12(25(18,22)23)6-7-15(14)21(2)3/h4-9H,1-3H3,(H2,18,22,23)(H2,19,20,24)