dimethyl 4-azanyl-5-methylsulfanyl-benzo[h][1,6]naphthyridine-2,3-dicarboxylate

Systemtic Name: dimethyl 4-azanyl-5-methylsulfanyl-benzo[h][1,6]naphthyridine-2,3-dicarboxylate Openeye Name: dimethyl 4-amino-5-methylsulfanyl-benzo[h][1,6]naphthyridine-2,3-dicarboxylate CAS Name: 4-amino-5-(methylthio)benzo[h][1,6]naphthyridine-2,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-amino-5-methylsulfanylbenzo[h][1,6]naphthyridine-2,3-dicarboxylate Traditional Name: 4-amino-5-(methylthio)benzo[h][1,6]naphthyridine-2,3-dicarboxylic acid dimethyl ester Formula: C17H15N3O4S MolecularWeight: 357.3837

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(C3=CC=CC=C3N=C2SC)N=C1C(=O)OC)N

Isomeric SMILES

COC(=O)C1=C(C2=C(C3=CC=CC=C3N=C2SC)N=C1C(=O)OC)N

InChI

InChI=1S/C17H15N3O4S/c1-23-16(21)11-12(18)10-13(20-14(11)17(22)24-2)8-6-4-5-7-9(8)19-15(10)25-3/h4-7H,1-3H3,(H2,18,20)