methyl 4-[[3-[(4-methoxyphenyl)carbamoyl]phenoxy]carbothioylamino]benzoate

Systemtic Name: methyl 4-[[3-[(4-methoxyphenyl)carbamoyl]phenoxy]carbothioylamino]benzoate Openeye Name: methyl 4-[[3-[(4-methoxyphenyl)carbamoyl]phenoxy]carbothioylamino]benzoate CAS Name: 4-[[[3-[(4-methoxyanilino)-oxomethyl]phenoxy]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-[(4-methoxyphenyl)carbamoyl]phenoxy]carbothioylamino]benzoate Traditional Name: 4-[[3-[(4-methoxyphenyl)carbamoyl]phenoxy]carbothioylamino]benzoic acid methyl ester Formula: C23H20N2O5S MolecularWeight: 436.4803

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)OC(=S)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)OC(=S)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C23H20N2O5S/c1-28-19-12-10-17(11-13-19)24-21(26)16-4-3-5-20(14-16)30-23(31)25-18-8-6-15(7-9-18)22(27)29-2/h3-14H,1-2H3,(H,24,26)(H,25,31)