N-(2-nitrophenyl)-2-pyridin-4-yl-5-sulfanylidene-7H-pyrrolo[3,4-b]pyridine-6-carboxamide

Systemtic Name: N-(2-nitrophenyl)-2-pyridin-4-yl-5-sulfanylidene-7H-pyrrolo[3,4-b]pyridine-6-carboxamide Openeye Name: N-(2-nitrophenyl)-2-(4-pyridyl)-5-thioxo-7H-pyrrolo[3,4-b]pyridine-6-carboxamide CAS Name: N-(2-nitrophenyl)-2-pyridin-4-yl-5-sulfanylidene-7H-pyrrolo[3,4-b]pyridine-6-carboxamide IUPAC Name: N-(2-nitrophenyl)-2-pyridin-4-yl-5-sulfanylidene-7H-pyrrolo[3,4-b]pyridine-6-carboxamide Traditional Name: N-(2-nitrophenyl)-2-(4-pyridyl)-5-thioxo-7H-pyrrolo[3,4-b]pyridine-6-carboxamide Formula: C19H13N5O3S MolecularWeight: 391.40322

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=N2)C3=CC=NC=C3)C(=S)N1C(=O)NC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1C2=C(C=CC(=N2)C3=CC=NC=C3)C(=S)N1C(=O)NC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C19H13N5O3S/c25-19(22-15-3-1-2-4-17(15)24(26)27)23-11-16-13(18(23)28)5-6-14(21-16)12-7-9-20-10-8-12/h1-10H,11H2,(H,22,25)