dimethyl 3-methyl-5-[(2-methyl-2,3-dihydroindol-1-yl)carbothioylamino]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-[(2-methyl-2,3-dihydroindol-1-yl)carbothioylamino]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-[(2-methylindoline-1-carbothioyl)amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[(2-methyl-2,3-dihydroindol-1-yl)-sulfanylidenemethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-[(2-methyl-2,3-dihydroindole-1-carbothioyl)amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[(2-methylindoline-1-carbothioyl)amino]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C19H20N2O4S2 MolecularWeight: 404.5031

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=S)NC3=C(C(=C(S3)C(=O)OC)C)C(=O)OC

Isomeric SMILES

CC1CC2=CC=CC=C2N1C(=S)NC3=C(C(=C(S3)C(=O)OC)C)C(=O)OC

InChI

InChI=1S/C19H20N2O4S2/c1-10-9-12-7-5-6-8-13(12)21(10)19(26)20-16-14(17(22)24-3)11(2)15(27-16)18(23)25-4/h5-8,10H,9H2,1-4H3,(H,20,26)