dimethyl 5-azanyl-3-(quinolin-2-ylsulfanylmethyl)thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-(quinolin-2-ylsulfanylmethyl)thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-(2-quinolylsulfanylmethyl)thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[(2-quinolinylthio)methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-(quinolin-2-ylsulfanylmethyl)thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[(2-quinolylthio)methyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C18H16N2O4S2 MolecularWeight: 388.46064

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1CSC2=NC3=CC=CC=C3C=C2)C(=O)OC)N

Isomeric SMILES

COC(=O)C1=C(SC(=C1CSC2=NC3=CC=CC=C3C=C2)C(=O)OC)N

InChI

InChI=1S/C18H16N2O4S2/c1-23-17(21)14-11(15(18(22)24-2)26-16(14)19)9-25-13-8-7-10-5-3-4-6-12(10)20-13/h3-8H,9,19H2,1-2H3