3,6-bis(azanyl)-5-cyano-4-(4-methylphenyl)-N-pyridin-4-yl-thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3,6-bis(azanyl)-5-cyano-4-(4-methylphenyl)-N-pyridin-4-yl-thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3,6-diamino-5-cyano-4-(p-tolyl)-N-(4-pyridyl)thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3,6-diamino-5-cyano-4-(4-methylphenyl)-N-pyridin-4-yl-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3,6-diamino-5-cyano-4-(4-methylphenyl)-N-pyridin-4-ylthieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3,6-diamino-5-cyano-4-(p-tolyl)-N-(4-pyridyl)thieno[2,3-b]pyridine-2-carboxamide Formula: C21H16N6OS MolecularWeight: 400.45634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=NC3=C2C(=C(S3)C(=O)NC4=CC=NC=C4)N)N)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=NC3=C2C(=C(S3)C(=O)NC4=CC=NC=C4)N)N)C#N

InChI

InChI=1S/C21H16N6OS/c1-11-2-4-12(5-3-11)15-14(10-22)19(24)27-21-16(15)17(23)18(29-21)20(28)26-13-6-8-25-9-7-13/h2-9H,23H2,1H3,(H2,24,27)(H,25,26,28)