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

Systemtic Name: N-[4-[6-azanyl-5-cyano-2-[(6-methylpyridin-2-yl)methylsulfanyl]pyrimidin-4-yl]phenyl]ethanamide Openeye Name: N-[4-[6-amino-5-cyano-2-[(6-methyl-2-pyridyl)methylsulfanyl]pyrimidin-4-yl]phenyl]acetamide CAS Name: N-[4-[6-amino-5-cyano-2-[(6-methyl-2-pyridinyl)methylthio]-4-pyrimidinyl]phenyl]acetamide IUPAC Name: N-[4-[6-amino-5-cyano-2-[(6-methylpyridin-2-yl)methylsulfanyl]pyrimidin-4-yl]phenyl]acetamide Traditional Name: N-[4-[6-amino-5-cyano-2-[(6-methyl-2-pyridyl)methylthio]pyrimidin-4-yl]phenyl]acetamide Formula: C20H18N6OS MolecularWeight: 390.46152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CSC2=NC(=C(C(=N2)N)C#N)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC1=NC(=CC=C1)CSC2=NC(=C(C(=N2)N)C#N)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C20H18N6OS/c1-12-4-3-5-16(23-12)11-28-20-25-18(17(10-21)19(22)26-20)14-6-8-15(9-7-14)24-13(2)27/h3-9H,11H2,1-2H3,(H,24,27)(H2,22,25,26)