2-(6-azanyl-3,5-dicyano-pyridin-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylphenyl)ethanamide

Systemtic Name: 2-(6-azanyl-3,5-dicyano-pyridin-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylphenyl)ethanamide Openeye Name: 2-[(6-amino-3,5-dicyano-2-pyridyl)sulfanyl]-N-(4-pyrrolidin-1-ylphenyl)acetamide CAS Name: 2-[(6-amino-3,5-dicyano-2-pyridinyl)thio]-N-[4-(1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-(6-amino-3,5-dicyanopyridin-2-yl)sulfanyl-N-(4-pyrrolidin-1-ylphenyl)acetamide Traditional Name: 2-[(6-amino-3,5-dicyano-2-pyridyl)thio]-N-(4-pyrrolidinophenyl)acetamide Formula: C19H18N6OS MolecularWeight: 378.45082

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)NC(=O)CSC3=C(C=C(C(=N3)N)C#N)C#N

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)NC(=O)CSC3=C(C=C(C(=N3)N)C#N)C#N

InChI

InChI=1S/C19H18N6OS/c20-10-13-9-14(11-21)19(24-18(13)22)27-12-17(26)23-15-3-5-16(6-4-15)25-7-1-2-8-25/h3-6,9H,1-2,7-8,12H2,(H2,22,24)(H,23,26)