2-(6-azanyl-3,5-dicyano-pyridin-2-yl)sulfanyl-N-dibenzofuran-2-yl-ethanamide

Systemtic Name: 2-(6-azanyl-3,5-dicyano-pyridin-2-yl)sulfanyl-N-dibenzofuran-2-yl-ethanamide Openeye Name: 2-[(6-amino-3,5-dicyano-2-pyridyl)sulfanyl]-N-dibenzofuran-2-yl-acetamide CAS Name: 2-[(6-amino-3,5-dicyano-2-pyridinyl)thio]-N-(2-dibenzofuranyl)acetamide IUPAC Name: 2-(6-amino-3,5-dicyanopyridin-2-yl)sulfanyl-N-dibenzofuran-2-ylacetamide Traditional Name: 2-[(6-amino-3,5-dicyano-2-pyridyl)thio]-N-dibenzofuran-2-yl-acetamide Formula: C21H13N5O2S MolecularWeight: 399.42522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)NC(=O)CSC4=C(C=C(C(=N4)N)C#N)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)NC(=O)CSC4=C(C=C(C(=N4)N)C#N)C#N

InChI

InChI=1S/C21H13N5O2S/c22-9-12-7-13(10-23)21(26-20(12)24)29-11-19(27)25-14-5-6-18-16(8-14)15-3-1-2-4-17(15)28-18/h1-8H,11H2,(H2,24,26)(H,25,27)