3-[[4-(5-methyl-3-methylsulfanyl-1,2-oxazol-4-yl)pyridin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 3-[[4-(5-methyl-3-methylsulfanyl-1,2-oxazol-4-yl)pyridin-2-yl]amino]benzenecarbonitrile Openeye Name: 3-[[4-(5-methyl-3-methylsulfanyl-isoxazol-4-yl)-2-pyridyl]amino]benzonitrile CAS Name: 3-[[4-[5-methyl-3-(methylthio)-4-isoxazolyl]-2-pyridinyl]amino]benzonitrile IUPAC Name: 3-[[4-(5-methyl-3-methylsulfanyl-1,2-oxazol-4-yl)pyridin-2-yl]amino]benzonitrile Traditional Name: 3-[[4-[5-methyl-3-(methylthio)isoxazol-4-yl]-2-pyridyl]amino]benzonitrile Formula: C17H14N4OS MolecularWeight: 322.38426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)SC)C2=CC(=NC=C2)NC3=CC=CC(=C3)C#N

Isomeric SMILES

CC1=C(C(=NO1)SC)C2=CC(=NC=C2)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C17H14N4OS/c1-11-16(17(23-2)21-22-11)13-6-7-19-15(9-13)20-14-5-3-4-12(8-14)10-18/h3-9H,1-2H3,(H,19,20)