4-methyl-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile

Systemtic Name: 4-methyl-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile Openeye Name: 4-methyl-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile CAS Name: 4-methyl-2-[[4-(1-pyrazolyl)phenyl]methylthio]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile IUPAC Name: 4-methyl-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile Traditional Name: 4-methyl-2-[(4-pyrazol-1-ylbenzyl)thio]-1-pyrindan-3-carbonitrile Formula: C20H18N4S MolecularWeight: 346.44872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=C1CCC2)SCC3=CC=C(C=C3)N4C=CC=N4)C#N

Isomeric SMILES

CC1=C(C(=NC2=C1CCC2)SCC3=CC=C(C=C3)N4C=CC=N4)C#N

InChI

InChI=1S/C20H18N4S/c1-14-17-4-2-5-19(17)23-20(18(14)12-21)25-13-15-6-8-16(9-7-15)24-11-3-10-22-24/h3,6-11H,2,4-5,13H2,1H3