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

Systemtic Name: 3-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]-N-pyridin-3-yl-propanamide Openeye Name: 3-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]-N-(3-pyridyl)propanamide CAS Name: 3-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)thio]-N-(3-pyridinyl)propanamide IUPAC Name: 3-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]-N-pyridin-3-ylpropanamide Traditional Name: 3-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)thio]-N-(3-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=CN=CC=C3

Isomeric SMILES

C1CCC2=C(CC1)N=C(C(=C2)C#N)SCCC(=O)NC3=CN=CC=C3

InChI

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