1-[[4-[(4-fluorophenyl)sulfonylamino]phenyl]carbonylamino]-3-(3-methoxyphenyl)thiourea

Systemtic Name: 1-[[4-[(4-fluorophenyl)sulfonylamino]phenyl]carbonylamino]-3-(3-methoxyphenyl)thiourea Openeye Name: 1-[[4-[(4-fluorophenyl)sulfonylamino]benzoyl]amino]-3-(3-methoxyphenyl)thiourea CAS Name: 1-[[[4-[(4-fluorophenyl)sulfonylamino]phenyl]-oxomethyl]amino]-3-(3-methoxyphenyl)thiourea IUPAC Name: 1-[[4-[(4-fluorophenyl)sulfonylamino]benzoyl]amino]-3-(3-methoxyphenyl)thiourea Traditional Name: 1-[[4-[(4-fluorophenyl)sulfonylamino]benzoyl]amino]-3-(3-methoxyphenyl)thiourea Formula: C21H19FN4O4S2 MolecularWeight: 474.528363

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)NNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)NNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H19FN4O4S2/c1-30-18-4-2-3-17(13-18)23-21(31)25-24-20(27)14-5-9-16(10-6-14)26-32(28,29)19-11-7-15(22)8-12-19/h2-13,26H,1H3,(H,24,27)(H2,23,25,31)