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

Systemtic Name: 3,6-bis(azanyl)-N-(2-azanyl-2-oxidanylidene-ethyl)-5-cyano-4-phenyl-thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3,6-diamino-N-(2-amino-2-oxo-ethyl)-5-cyano-4-phenyl-thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3,6-diamino-N-(2-amino-2-oxoethyl)-5-cyano-4-phenyl-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3,6-diamino-N-(2-amino-2-oxoethyl)-5-cyano-4-phenylthieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3,6-diamino-N-(2-amino-2-keto-ethyl)-5-cyano-4-phenyl-thieno[2,3-b]pyridine-2-carboxamide Formula: C17H14N6O2S MolecularWeight: 366.39706

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=NC3=C2C(=C(S3)C(=O)NCC(=O)N)N)N)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=NC3=C2C(=C(S3)C(=O)NCC(=O)N)N)N)C#N

InChI

InChI=1S/C17H14N6O2S/c18-6-9-11(8-4-2-1-3-5-8)12-13(20)14(16(25)22-7-10(19)24)26-17(12)23-15(9)21/h1-5H,7,20H2,(H2,19,24)(H2,21,23)(H,22,25)