N-[(6-azanyl-2-methyl-pyridin-3-yl)methyl]-2-[6-(methylsulfanylmethyl)-2-oxidanylidene-3-(phenethylamino)pyrazin-1-yl]ethanamide

Systemtic Name: N-[(6-azanyl-2-methyl-pyridin-3-yl)methyl]-2-[6-(methylsulfanylmethyl)-2-oxidanylidene-3-(phenethylamino)pyrazin-1-yl]ethanamide Openeye Name: N-[(6-amino-2-methyl-3-pyridyl)methyl]-2-[6-(methylsulfanylmethyl)-2-oxo-3-(phenethylamino)pyrazin-1-yl]acetamide CAS Name: N-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-[6-[(methylthio)methyl]-2-oxo-3-(phenethylamino)-1-pyrazinyl]acetamide IUPAC Name: N-[(6-amino-2-methylpyridin-3-yl)methyl]-2-[6-(methylsulfanylmethyl)-2-oxo-3-(phenethylamino)pyrazin-1-yl]acetamide Traditional Name: N-[(6-amino-2-methyl-3-pyridyl)methyl]-2-[2-keto-6-[(methylthio)methyl]-3-(phenethylamino)pyrazin-1-yl]acetamide Formula: C23H28N6O2S MolecularWeight: 452.57242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)N)CNC(=O)CN2C(=CN=C(C2=O)NCCC3=CC=CC=C3)CSC

Isomeric SMILES

CC1=C(C=CC(=N1)N)CNC(=O)CN2C(=CN=C(C2=O)NCCC3=CC=CC=C3)CSC

InChI

InChI=1S/C23H28N6O2S/c1-16-18(8-9-20(24)28-16)12-26-21(30)14-29-19(15-32-2)13-27-22(23(29)31)25-11-10-17-6-4-3-5-7-17/h3-9,13H,10-12,14-15H2,1-2H3,(H2,24,28)(H,25,27)(H,26,30)