3-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]-N-pyridin-2-yl-propanamide

Systemtic Name: 3-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]-N-pyridin-2-yl-propanamide Openeye Name: 3-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]-N-(2-pyridyl)propanamide CAS Name: 3-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)thio]-N-(2-pyridinyl)propanamide IUPAC Name: 3-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]-N-pyridin-2-ylpropanamide Traditional Name: 3-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)thio]-N-(2-pyridyl)propionamide Formula: C19H20N4OS MolecularWeight: 352.4533

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)N=C(C(=C2)C#N)SCCC(=O)NC3=CC=CC=N3

Isomeric SMILES

C1CCC2=C(CC1)N=C(C(=C2)C#N)SCCC(=O)NC3=CC=CC=N3

InChI

InChI=1S/C19H20N4OS/c20-13-15-12-14-6-2-1-3-7-16(14)22-19(15)25-11-9-18(24)23-17-8-4-5-10-21-17/h4-5,8,10,12H,1-3,6-7,9,11H2,(H,21,23,24)