4-azanyl-6-methylsulfanyl-2-(phenoxymethyl)pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-6-methylsulfanyl-2-(phenoxymethyl)pyrimidine-5-carbonitrile Openeye Name: 4-amino-6-methylsulfanyl-2-(phenoxymethyl)pyrimidine-5-carbonitrile CAS Name: 4-amino-6-(methylthio)-2-(phenoxymethyl)-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-6-methylsulfanyl-2-(phenoxymethyl)pyrimidine-5-carbonitrile Traditional Name: 4-amino-6-(methylthio)-2-(phenoxymethyl)pyrimidine-5-carbonitrile Formula: C13H12N4OS MolecularWeight: 272.32558

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC(=C1C#N)N)COC2=CC=CC=C2

Isomeric SMILES

CSC1=NC(=NC(=C1C#N)N)COC2=CC=CC=C2

InChI

InChI=1S/C13H12N4OS/c1-19-13-10(7-14)12(15)16-11(17-13)8-18-9-5-3-2-4-6-9/h2-6H,8H2,1H3,(H2,15,16,17)