4-pyridin-4-yl-2-sulfanylidene-3,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carbonitrile

Systemtic Name: 4-pyridin-4-yl-2-sulfanylidene-3,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carbonitrile Openeye Name: 4-(4-pyridyl)-2-thioxo-3,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carbonitrile CAS Name: 4-pyridin-4-yl-2-sulfanylidene-3,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carbonitrile IUPAC Name: 4-pyridin-4-yl-2-sulfanylidene-3,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carbonitrile Traditional Name: 4-(4-pyridyl)-2-thioxo-3,5,6,7-tetrahydro-1-pyrindine-3-carbonitrile Formula: C14H11N3S MolecularWeight: 253.32224

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C(=S)N=C2C1)C#N)C3=CC=NC=C3

Isomeric SMILES

C1CC2=C(C(C(=S)N=C2C1)C#N)C3=CC=NC=C3

InChI

InChI=1S/C14H11N3S/c15-8-11-13(9-4-6-16-7-5-9)10-2-1-3-12(10)17-14(11)18/h4-7,11H,1-3H2