methyl 4-[2-[(4-methylphenyl)carbamothioylamino]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: methyl 4-[2-[(4-methylphenyl)carbamothioylamino]-2-oxidanylidene-ethoxy]benzoate Openeye Name: methyl 4-[2-oxo-2-(p-tolylcarbamothioylamino)ethoxy]benzoate CAS Name: 4-[2-[[(4-methylanilino)-sulfanylidenemethyl]amino]-2-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[(4-methylphenyl)carbamothioylamino]-2-oxoethoxy]benzoate Traditional Name: 4-[2-keto-2-(p-tolylthiocarbamoylamino)ethoxy]benzoic acid methyl ester Formula: C18H18N2O4S MolecularWeight: 358.41152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NC(=O)COC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NC(=O)COC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C18H18N2O4S/c1-12-3-7-14(8-4-12)19-18(25)20-16(21)11-24-15-9-5-13(6-10-15)17(22)23-2/h3-10H,11H2,1-2H3,(H2,19,20,21,25)