6-cyclopropyl-4-phenyl-2-(phenylmethylsulfanyl)pyridine-3-carbonitrile

Systemtic Name: 6-cyclopropyl-4-phenyl-2-(phenylmethylsulfanyl)pyridine-3-carbonitrile Openeye Name: 2-benzylsulfanyl-6-cyclopropyl-4-phenyl-pyridine-3-carbonitrile CAS Name: 6-cyclopropyl-4-phenyl-2-(phenylmethylthio)-3-pyridinecarbonitrile IUPAC Name: 2-benzylsulfanyl-6-cyclopropyl-4-phenylpyridine-3-carbonitrile Traditional Name: 2-(benzylthio)-6-cyclopropyl-4-phenyl-nicotinonitrile Formula: C22H18N2S MolecularWeight: 342.45672

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC4=CC=CC=C4

Isomeric SMILES

C1CC1C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC4=CC=CC=C4

InChI

InChI=1S/C22H18N2S/c23-14-20-19(17-9-5-2-6-10-17)13-21(18-11-12-18)24-22(20)25-15-16-7-3-1-4-8-16/h1-10,13,18H,11-12,15H2