3-chloranyl-5-[(6-pyrazol-1-ylpyridin-3-yl)methylamino]-1,2-thiazole-4-carbonitrile

Systemtic Name: 3-chloranyl-5-[(6-pyrazol-1-ylpyridin-3-yl)methylamino]-1,2-thiazole-4-carbonitrile Openeye Name: 3-chloro-5-[(6-pyrazol-1-yl-3-pyridyl)methylamino]isothiazole-4-carbonitrile CAS Name: 3-chloro-5-[[6-(1-pyrazolyl)-3-pyridinyl]methylamino]-4-isothiazolecarbonitrile IUPAC Name: 3-chloro-5-[(6-pyrazol-1-ylpyridin-3-yl)methylamino]-1,2-thiazole-4-carbonitrile Traditional Name: 3-chloro-5-[(6-pyrazol-1-yl-3-pyridyl)methylamino]isothiazole-4-carbonitrile Formula: C13H9ClN6S MolecularWeight: 316.76876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=NC=C(C=C2)CNC3=C(C(=NS3)Cl)C#N

Isomeric SMILES

C1=CN(N=C1)C2=NC=C(C=C2)CNC3=C(C(=NS3)Cl)C#N

InChI

InChI=1S/C13H9ClN6S/c14-12-10(6-15)13(21-19-12)17-8-9-2-3-11(16-7-9)20-5-1-4-18-20/h1-5,7,17H,8H2