methyl 3-[2-(4-methoxyphenyl)ethylcarbamothioylamino]benzoate

Systemtic Name: methyl 3-[2-(4-methoxyphenyl)ethylcarbamothioylamino]benzoate Openeye Name: methyl 3-[2-(4-methoxyphenyl)ethylcarbamothioylamino]benzoate CAS Name: 3-[[[2-(4-methoxyphenyl)ethylamino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[2-(4-methoxyphenyl)ethylcarbamothioylamino]benzoate Traditional Name: 3-[2-(4-methoxyphenyl)ethylthiocarbamoylamino]benzoic acid methyl ester Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=S)NC2=CC=CC(=C2)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=S)NC2=CC=CC(=C2)C(=O)OC

InChI

InChI=1S/C18H20N2O3S/c1-22-16-8-6-13(7-9-16)10-11-19-18(24)20-15-5-3-4-14(12-15)17(21)23-2/h3-9,12H,10-11H2,1-2H3,(H2,19,20,24)