1-(4-fluorophenyl)-3-[[4-[(4-methoxyphenyl)sulfamoyl]-2-nitro-phenyl]amino]thiourea

Systemtic Name: 1-(4-fluorophenyl)-3-[[4-[(4-methoxyphenyl)sulfamoyl]-2-nitro-phenyl]amino]thiourea Openeye Name: 1-(4-fluorophenyl)-3-[4-[(4-methoxyphenyl)sulfamoyl]-2-nitro-anilino]thiourea CAS Name: 1-(4-fluorophenyl)-3-[4-[(4-methoxyphenyl)sulfamoyl]-2-nitroanilino]thiourea IUPAC Name: 1-(4-fluorophenyl)-3-[4-[(4-methoxyphenyl)sulfamoyl]-2-nitroanilino]thiourea Traditional Name: 1-(4-fluorophenyl)-3-[4-[(4-methoxyphenyl)sulfamoyl]-2-nitro-anilino]thiourea Formula: C20H18FN5O5S2 MolecularWeight: 491.515823

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)NNC(=S)NC3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)NNC(=S)NC3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C20H18FN5O5S2/c1-31-16-8-6-15(7-9-16)25-33(29,30)17-10-11-18(19(12-17)26(27)28)23-24-20(32)22-14-4-2-13(21)3-5-14/h2-12,23,25H,1H3,(H2,22,24,32)