dimethyl 3-methyl-5-[(2-methyl-6-propan-2-yl-phenyl)carbamothioylamino]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-[(2-methyl-6-propan-2-yl-phenyl)carbamothioylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-[(2-isopropyl-6-methyl-phenyl)carbamothioylamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[(2-methyl-6-propan-2-ylanilino)-sulfanylidenemethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-[(2-methyl-6-propan-2-ylphenyl)carbamothioylamino]thiophene-2,4-dicarboxylate Traditional Name: 5-[(2-isopropyl-6-methyl-phenyl)thiocarbamoylamino]-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C20H24N2O4S2 MolecularWeight: 420.54556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC(=S)NC2=C(C(=C(S2)C(=O)OC)C)C(=O)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=S)NC2=C(C(=C(S2)C(=O)OC)C)C(=O)OC

InChI

InChI=1S/C20H24N2O4S2/c1-10(2)13-9-7-8-11(3)15(13)21-20(27)22-17-14(18(23)25-5)12(4)16(28-17)19(24)26-6/h7-10H,1-6H3,(H2,21,22,27)