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

Systemtic Name: diethyl 3-methyl-5-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]carbothioylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[[(2R)-2-methylindoline-1-carbothioyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[[(2R)-2-methyl-2,3-dihydroindol-1-yl]-sulfanylidenemethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[[(2R)-2-methyl-2,3-dihydroindole-1-carbothioyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[(2R)-2-methylindoline-1-carbothioyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C21H24N2O4S2 MolecularWeight: 432.55626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)N2C(CC3=CC=CC=C32)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)N2[C@@H](CC3=CC=CC=C32)C

InChI

InChI=1S/C21H24N2O4S2/c1-5-26-19(24)16-13(4)17(20(25)27-6-2)29-18(16)22-21(28)23-12(3)11-14-9-7-8-10-15(14)23/h7-10,12H,5-6,11H2,1-4H3,(H,22,28)/t12-/m1/s1