dimethyl 5-[(3-methylphenyl)carbamothioylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[(3-methylphenyl)carbamothioylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-(m-tolylcarbamothioylamino)benzene-1,3-dicarboxylate CAS Name: 5-[[(3-methylanilino)-sulfanylidenemethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(3-methylphenyl)carbamothioylamino]benzene-1,3-dicarboxylate Traditional Name: 5-(m-tolylthiocarbamoylamino)benzene-1,3-dicarboxylic acid dimethyl ester Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C18H18N2O4S/c1-11-5-4-6-14(7-11)19-18(25)20-15-9-12(16(21)23-2)8-13(10-15)17(22)24-3/h4-10H,1-3H3,(H2,19,20,25)