2-[2-[(4-methoxypyrimidin-2-yl)amino]ethylsulfanylmethyl]benzenecarbonitrile

Systemtic Name: 2-[2-[(4-methoxypyrimidin-2-yl)amino]ethylsulfanylmethyl]benzenecarbonitrile Openeye Name: 2-[2-[(4-methoxypyrimidin-2-yl)amino]ethylsulfanylmethyl]benzonitrile CAS Name: 2-[[2-[(4-methoxy-2-pyrimidinyl)amino]ethylthio]methyl]benzonitrile IUPAC Name: 2-[2-[(4-methoxypyrimidin-2-yl)amino]ethylsulfanylmethyl]benzonitrile Traditional Name: 2-[[2-[(4-methoxypyrimidin-2-yl)amino]ethylthio]methyl]benzonitrile Formula: C15H16N4OS MolecularWeight: 300.37874

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC=C1)NCCSCC2=CC=CC=C2C#N

Isomeric SMILES

COC1=NC(=NC=C1)NCCSCC2=CC=CC=C2C#N

InChI

InChI=1S/C15H16N4OS/c1-20-14-6-7-17-15(19-14)18-8-9-21-11-13-5-3-2-4-12(13)10-16/h2-7H,8-9,11H2,1H3,(H,17,18,19)