2-[(4-tert-butylphenyl)methylsulfanyl]-4-pyridin-3-yl-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-4-pyridin-3-yl-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile Openeye Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-4-(3-pyridyl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile CAS Name: 2-[(4-tert-butylphenyl)methylthio]-4-(3-pyridinyl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile IUPAC Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-4-pyridin-3-yl-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile Traditional Name: 2-[(4-tert-butylbenzyl)thio]-4-(3-pyridyl)-1-pyrindan-3-carbonitrile Formula: C25H25N3S MolecularWeight: 399.5511

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=C(CCC3)C(=C2C#N)C4=CN=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=C(CCC3)C(=C2C#N)C4=CN=CC=C4

InChI

InChI=1S/C25H25N3S/c1-25(2,3)19-11-9-17(10-12-19)16-29-24-21(14-26)23(18-6-5-13-27-15-18)20-7-4-8-22(20)28-24/h5-6,9-13,15H,4,7-8,16H2,1-3H3