methyl 4-(4-fluorophenyl)sulfanyl-3-[(3-methoxyphenyl)carbamoylamino]benzoate

Systemtic Name: methyl 4-(4-fluorophenyl)sulfanyl-3-[(3-methoxyphenyl)carbamoylamino]benzoate Openeye Name: methyl 4-(4-fluorophenyl)sulfanyl-3-[(3-methoxyphenyl)carbamoylamino]benzoate CAS Name: 4-[(4-fluorophenyl)thio]-3-[[(3-methoxyanilino)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-(4-fluorophenyl)sulfanyl-3-[(3-methoxyphenyl)carbamoylamino]benzoate Traditional Name: 4-[(4-fluorophenyl)thio]-3-[(3-methoxyphenyl)carbamoylamino]benzoic acid methyl ester Formula: C22H19FN2O4S MolecularWeight: 426.460663

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)NC2=C(C=CC(=C2)C(=O)OC)SC3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)NC2=C(C=CC(=C2)C(=O)OC)SC3=CC=C(C=C3)F

InChI

InChI=1S/C22H19FN2O4S/c1-28-17-5-3-4-16(13-17)24-22(27)25-19-12-14(21(26)29-2)6-11-20(19)30-18-9-7-15(23)8-10-18/h3-13H,1-2H3,(H2,24,25,27)