ethyl 3-(2-methyl-4-pyridin-3-yl-5-sulfanylidene-7H-pyrrolo[3,4-b]pyridin-6-yl)-3-oxidanylidene-propanoate

Systemtic Name: ethyl 3-(2-methyl-4-pyridin-3-yl-5-sulfanylidene-7H-pyrrolo[3,4-b]pyridin-6-yl)-3-oxidanylidene-propanoate Openeye Name: ethyl 3-[2-methyl-4-(3-pyridyl)-5-thioxo-7H-pyrrolo[3,4-b]pyridin-6-yl]-3-oxo-propanoate CAS Name: 3-[2-methyl-4-(3-pyridinyl)-5-sulfanylidene-7H-pyrrolo[3,4-b]pyridin-6-yl]-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 3-(2-methyl-4-pyridin-3-yl-5-sulfanylidene-7H-pyrrolo[3,4-b]pyridin-6-yl)-3-oxopropanoate Traditional Name: 3-keto-3-[2-methyl-4-(3-pyridyl)-5-thioxo-7H-pyrrolo[3,4-b]pyridin-6-yl]propionic acid ethyl ester Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)N1CC2=C(C1=S)C(=CC(=N2)C)C3=CN=CC=C3

Isomeric SMILES

CCOC(=O)CC(=O)N1CC2=C(C1=S)C(=CC(=N2)C)C3=CN=CC=C3

InChI

InChI=1S/C18H17N3O3S/c1-3-24-16(23)8-15(22)21-10-14-17(18(21)25)13(7-11(2)20-14)12-5-4-6-19-9-12/h4-7,9H,3,8,10H2,1-2H3