4-azanyl-2-hexylsulfanyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-azanyl-2-hexylsulfanyl-pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-hexylsulfanyl-pyrimidine-5-carbonitrile CAS Name: 4-amino-2-(hexylthio)-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-hexylsulfanylpyrimidine-5-carbonitrile Traditional Name: 4-amino-2-(hexylthio)pyrimidine-5-carbonitrile Formula: C11H16N4S MolecularWeight: 236.33654

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=NC=C(C(=N1)N)C#N

Isomeric SMILES

CCCCCCSC1=NC=C(C(=N1)N)C#N

InChI

InChI=1S/C11H16N4S/c1-2-3-4-5-6-16-11-14-8-9(7-12)10(13)15-11/h8H,2-6H2,1H3,(H2,13,14,15)