N-[4-[6-azanyl-5-cyano-2-(pyridin-2-ylmethylsulfanyl)pyrimidin-4-yl]phenyl]ethanamide

Systemtic Name: N-[4-[6-azanyl-5-cyano-2-(pyridin-2-ylmethylsulfanyl)pyrimidin-4-yl]phenyl]ethanamide Openeye Name: N-[4-[6-amino-5-cyano-2-(2-pyridylmethylsulfanyl)pyrimidin-4-yl]phenyl]acetamide CAS Name: N-[4-[6-amino-5-cyano-2-(2-pyridinylmethylthio)-4-pyrimidinyl]phenyl]acetamide IUPAC Name: N-[4-[6-amino-5-cyano-2-(pyridin-2-ylmethylsulfanyl)pyrimidin-4-yl]phenyl]acetamide Traditional Name: N-[4-[6-amino-5-cyano-2-(2-pyridylmethylthio)pyrimidin-4-yl]phenyl]acetamide Formula: C19H16N6OS MolecularWeight: 376.43494

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2=C(C(=NC(=N2)SCC3=CC=CC=N3)N)C#N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=C(C(=NC(=N2)SCC3=CC=CC=N3)N)C#N

InChI

InChI=1S/C19H16N6OS/c1-12(26)23-14-7-5-13(6-8-14)17-16(10-20)18(21)25-19(24-17)27-11-15-4-2-3-9-22-15/h2-9H,11H2,1H3,(H,23,26)(H2,21,24,25)