2-[4-[(1-methylpyrazol-3-yl)amino]pyrido[3,2-d]pyrimidin-6-yl]sulfanylpyridine-3-carbonitrile

Systemtic Name: 2-[4-[(1-methylpyrazol-3-yl)amino]pyrido[3,2-d]pyrimidin-6-yl]sulfanylpyridine-3-carbonitrile Openeye Name: 2-[4-[(1-methylpyrazol-3-yl)amino]pyrido[3,2-d]pyrimidin-6-yl]sulfanylpyridine-3-carbonitrile CAS Name: 2-[[4-[(1-methyl-3-pyrazolyl)amino]-6-pyrido[3,2-d]pyrimidinyl]thio]-3-pyridinecarbonitrile IUPAC Name: 2-[4-[(1-methylpyrazol-3-yl)amino]pyrido[3,2-d]pyrimidin-6-yl]sulfanylpyridine-3-carbonitrile Traditional Name: 2-[[4-[(1-methylpyrazol-3-yl)amino]pyrido[3,2-d]pyrimidin-6-yl]thio]nicotinonitrile Formula: C17H12N8S MolecularWeight: 360.39578

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)NC2=NC=NC3=C2N=C(C=C3)SC4=C(C=CC=N4)C#N

Isomeric SMILES

CN1C=CC(=N1)NC2=NC=NC3=C2N=C(C=C3)SC4=C(C=CC=N4)C#N

InChI

InChI=1S/C17H12N8S/c1-25-8-6-13(24-25)22-16-15-12(20-10-21-16)4-5-14(23-15)26-17-11(9-18)3-2-7-19-17/h2-8,10H,1H3,(H,20,21,22,24)