dimethyl 2-[(4-propan-2-ylphenyl)carbamothioylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[(4-propan-2-ylphenyl)carbamothioylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[(4-isopropylphenyl)carbamothioylamino]benzene-1,4-dicarboxylate CAS Name: 2-[[(4-propan-2-ylanilino)-sulfanylidenemethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[(4-propan-2-ylphenyl)carbamothioylamino]benzene-1,4-dicarboxylate Traditional Name: 2-(p-cumenylthiocarbamoylamino)benzene-1,4-dicarboxylic acid dimethyl ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O4S/c1-12(2)13-5-8-15(9-6-13)21-20(27)22-17-11-14(18(23)25-3)7-10-16(17)19(24)26-4/h5-12H,1-4H3,(H2,21,22,27)