1-[(4-fluorophenyl)methyl]-3-[(2-methoxy-5-sulfamoyl-phenyl)carbonylamino]thiourea

Systemtic Name: 1-[(4-fluorophenyl)methyl]-3-[(2-methoxy-5-sulfamoyl-phenyl)carbonylamino]thiourea Openeye Name: 1-[(4-fluorophenyl)methyl]-3-[(2-methoxy-5-sulfamoyl-benzoyl)amino]thiourea CAS Name: 1-[(4-fluorophenyl)methyl]-3-[[(2-methoxy-5-sulfamoylphenyl)-oxomethyl]amino]thiourea IUPAC Name: 1-[(4-fluorophenyl)methyl]-3-[(2-methoxy-5-sulfamoylbenzoyl)amino]thiourea Traditional Name: 1-(4-fluorobenzyl)-3-[(2-methoxy-5-sulfamoyl-benzoyl)amino]thiourea Formula: C16H17FN4O4S2 MolecularWeight: 412.458983

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)NNC(=S)NCC2=CC=C(C=C2)F

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)NNC(=S)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C16H17FN4O4S2/c1-25-14-7-6-12(27(18,23)24)8-13(14)15(22)20-21-16(26)19-9-10-2-4-11(17)5-3-10/h2-8H,9H2,1H3,(H,20,22)(H2,18,23,24)(H2,19,21,26)