dimethyl 5-(2,3-dihydroindol-1-ylcarbothioylamino)-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-(2,3-dihydroindol-1-ylcarbothioylamino)-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-(indoline-1-carbothioylamino)-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[2,3-dihydroindol-1-yl(sulfanylidene)methyl]amino]-3-methylthiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-(2,3-dihydroindole-1-carbothioylamino)-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-(indoline-1-carbothioylamino)-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C18H18N2O4S2 MolecularWeight: 390.47652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=S)N2CCC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=S)N2CCC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C18H18N2O4S2/c1-10-13(16(21)23-2)15(26-14(10)17(22)24-3)19-18(25)20-9-8-11-6-4-5-7-12(11)20/h4-7H,8-9H2,1-3H3,(H,19,25)