N-(1-methyl-6-oxidanylidene-4-thiophen-2-yl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-3-yl)-5-nitro-furan-2-carboxamide

Systemtic Name: N-(1-methyl-6-oxidanylidene-4-thiophen-2-yl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-3-yl)-5-nitro-furan-2-carboxamide Openeye Name: N-[1-methyl-6-oxo-4-(2-thienyl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-3-yl]-5-nitro-furan-2-carboxamide CAS Name: N-(1-methyl-6-oxo-4-thiophen-2-yl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-3-yl)-5-nitro-2-furancarboxamide IUPAC Name: N-(1-methyl-6-oxo-4-thiophen-2-yl-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-3-yl)-5-nitrofuran-2-carboxamide Traditional Name: N-[6-keto-1-methyl-4-(2-thienyl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-3-yl]-5-nitro-2-furamide Formula: C16H13N5O5S MolecularWeight: 387.36992

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NC(=O)CC(C2=C(N1)NC(=O)C3=CC=C(O3)[N+](=O)[O-])C4=CC=CS4

Isomeric SMILES

CN1C2=NC(=O)CC(C2=C(N1)NC(=O)C3=CC=C(O3)[N+](=O)[O-])C4=CC=CS4

InChI

InChI=1S/C16H13N5O5S/c1-20-15-13(8(7-11(22)17-15)10-3-2-6-27-10)14(19-20)18-16(23)9-4-5-12(26-9)21(24)25/h2-6,8,19H,7H2,1H3,(H,18,23)