dimethyl 3-methyl-5-(2-quinolin-2-ylsulfanylethanoylamino)thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-(2-quinolin-2-ylsulfanylethanoylamino)thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-[[2-(2-quinolylsulfanyl)acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[1-oxo-2-(2-quinolinylthio)ethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-[(2-quinolin-2-ylsulfanylacetyl)amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-(2-quinolylthio)acetyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C20H18N2O5S2 MolecularWeight: 430.49732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CSC2=NC3=CC=CC=C3C=C2)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CSC2=NC3=CC=CC=C3C=C2)C(=O)OC

InChI

InChI=1S/C20H18N2O5S2/c1-11-16(19(24)26-2)18(29-17(11)20(25)27-3)22-14(23)10-28-15-9-8-12-6-4-5-7-13(12)21-15/h4-9H,10H2,1-3H3,(H,22,23)