3,6-bis(azanyl)-5-cyano-N-(4-methoxy-2-nitro-phenyl)thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3,6-bis(azanyl)-5-cyano-N-(4-methoxy-2-nitro-phenyl)thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3,6-diamino-5-cyano-N-(4-methoxy-2-nitro-phenyl)thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3,6-diamino-5-cyano-N-(4-methoxy-2-nitrophenyl)-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3,6-diamino-5-cyano-N-(4-methoxy-2-nitrophenyl)thieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3,6-diamino-5-cyano-N-(4-methoxy-2-nitro-phenyl)thieno[2,3-b]pyridine-2-carboxamide Formula: C16H12N6O4S MolecularWeight: 384.36928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C2=C(C3=C(S2)N=C(C(=C3)C#N)N)N)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)C2=C(C3=C(S2)N=C(C(=C3)C#N)N)N)[N+](=O)[O-]

InChI

InChI=1S/C16H12N6O4S/c1-26-8-2-3-10(11(5-8)22(24)25)20-15(23)13-12(18)9-4-7(6-17)14(19)21-16(9)27-13/h2-5H,18H2,1H3,(H2,19,21)(H,20,23)