2-(cyanomethylsulfanyl)-4-pyridin-3-yl-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-(cyanomethylsulfanyl)-4-pyridin-3-yl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-(cyanomethylsulfanyl)-4-(3-pyridyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-(cyanomethylthio)-4-(3-pyridinyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-(cyanomethylsulfanyl)-4-pyridin-3-yl-5,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-(cyanomethylthio)-4-(3-pyridyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C17H14N4S MolecularWeight: 306.38486

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(C(=N2)SCC#N)C#N)C3=CN=CC=C3

Isomeric SMILES

C1CCC2=C(C1)C(=C(C(=N2)SCC#N)C#N)C3=CN=CC=C3

InChI

InChI=1S/C17H14N4S/c18-7-9-22-17-14(10-19)16(12-4-3-8-20-11-12)13-5-1-2-6-15(13)21-17/h3-4,8,11H,1-2,5-6,9H2