methyl 4,5-dimethoxy-2-[(3-methylphenyl)carbamothioylamino]benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-[(3-methylphenyl)carbamothioylamino]benzoate Openeye Name: methyl 4,5-dimethoxy-2-(m-tolylcarbamothioylamino)benzoate CAS Name: 4,5-dimethoxy-2-[[(3-methylanilino)-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4,5-dimethoxy-2-[(3-methylphenyl)carbamothioylamino]benzoate Traditional Name: 4,5-dimethoxy-2-(m-tolylthiocarbamoylamino)benzoic acid methyl ester Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)NC2=CC(=C(C=C2C(=O)OC)OC)OC

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)NC2=CC(=C(C=C2C(=O)OC)OC)OC

InChI

InChI=1S/C18H20N2O4S/c1-11-6-5-7-12(8-11)19-18(25)20-14-10-16(23-3)15(22-2)9-13(14)17(21)24-4/h5-10H,1-4H3,(H2,19,20,25)