2-[1-(4-azanyl-6-chloranyl-pyrimidin-2-yl)sulfanylethyl]pyridine-4-carbonitrile

Systemtic Name: 2-[1-(4-azanyl-6-chloranyl-pyrimidin-2-yl)sulfanylethyl]pyridine-4-carbonitrile Openeye Name: 2-[1-(4-amino-6-chloro-pyrimidin-2-yl)sulfanylethyl]pyridine-4-carbonitrile CAS Name: 2-[1-[(4-amino-6-chloro-2-pyrimidinyl)thio]ethyl]-4-pyridinecarbonitrile IUPAC Name: 2-[1-(4-amino-6-chloropyrimidin-2-yl)sulfanylethyl]pyridine-4-carbonitrile Traditional Name: 2-[1-[(4-amino-6-chloro-pyrimidin-2-yl)thio]ethyl]isonicotinonitrile Formula: C12H10ClN5S MolecularWeight: 291.7593

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC=CC(=C1)C#N)SC2=NC(=CC(=N2)Cl)N

Isomeric SMILES

CC(C1=NC=CC(=C1)C#N)SC2=NC(=CC(=N2)Cl)N

InChI

InChI=1S/C12H10ClN5S/c1-7(9-4-8(6-14)2-3-16-9)19-12-17-10(13)5-11(15)18-12/h2-5,7H,1H3,(H2,15,17,18)