4-azanyl-2-(oxan-2-ylmethylsulfanyl)pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-(oxan-2-ylmethylsulfanyl)pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-(tetrahydropyran-2-ylmethylsulfanyl)pyrimidine-5-carbonitrile CAS Name: 4-amino-2-(2-oxanylmethylthio)-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-(oxan-2-ylmethylsulfanyl)pyrimidine-5-carbonitrile Traditional Name: 4-amino-2-(tetrahydropyran-2-ylmethylthio)pyrimidine-5-carbonitrile Formula: C11H14N4OS MolecularWeight: 250.32006

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)CSC2=NC=C(C(=N2)N)C#N

Isomeric SMILES

C1CCOC(C1)CSC2=NC=C(C(=N2)N)C#N

InChI

InChI=1S/C11H14N4OS/c12-5-8-6-14-11(15-10(8)13)17-7-9-3-1-2-4-16-9/h6,9H,1-4,7H2,(H2,13,14,15)