2-[(4-azanyl-6-chloranyl-pyrimidin-2-yl)sulfanylmethyl]pyridine-4-carbonitrile

Systemtic Name: 2-[(4-azanyl-6-chloranyl-pyrimidin-2-yl)sulfanylmethyl]pyridine-4-carbonitrile Openeye Name: 2-[(4-amino-6-chloro-pyrimidin-2-yl)sulfanylmethyl]pyridine-4-carbonitrile CAS Name: 2-[[(4-amino-6-chloro-2-pyrimidinyl)thio]methyl]-4-pyridinecarbonitrile IUPAC Name: 2-[(4-amino-6-chloropyrimidin-2-yl)sulfanylmethyl]pyridine-4-carbonitrile Traditional Name: 2-[[(4-amino-6-chloro-pyrimidin-2-yl)thio]methyl]isonicotinonitrile Formula: C11H8ClN5S MolecularWeight: 277.73272

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(C=C1C#N)CSC2=NC(=CC(=N2)Cl)N

Isomeric SMILES

C1=CN=C(C=C1C#N)CSC2=NC(=CC(=N2)Cl)N

InChI

InChI=1S/C11H8ClN5S/c12-9-4-10(14)17-11(16-9)18-6-8-3-7(5-13)1-2-15-8/h1-4H,6H2,(H2,14,16,17)