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

Systemtic Name: 2-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]-N,N-diphenyl-ethanamide Openeye Name: 2-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]-N,N-diphenyl-acetamide CAS Name: 2-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)thio]-N,N-diphenylacetamide IUPAC Name: 2-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)sulfanyl]-N,N-diphenylacetamide Traditional Name: 2-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)thio]-N,N-diphenyl-acetamide Formula: C25H23N3OS MolecularWeight: 413.53462

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)N=C(C(=C2)C#N)SCC(=O)N(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(CC1)N=C(C(=C2)C#N)SCC(=O)N(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H23N3OS/c26-17-20-16-19-10-4-1-9-15-23(19)27-25(20)30-18-24(29)28(21-11-5-2-6-12-21)22-13-7-3-8-14-22/h2-3,5-8,11-14,16H,1,4,9-10,15,18H2