N-[3-cyano-1-(oxolan-2-ylmethyl)-4,5,6,7-tetrahydroindol-2-yl]-2-pyridin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[3-cyano-1-(oxolan-2-ylmethyl)-4,5,6,7-tetrahydroindol-2-yl]-2-pyridin-2-ylsulfanyl-ethanamide Openeye Name: N-[3-cyano-1-(tetrahydrofuran-2-ylmethyl)-4,5,6,7-tetrahydroindol-2-yl]-2-(2-pyridylsulfanyl)acetamide CAS Name: N-[3-cyano-1-(2-oxolanylmethyl)-4,5,6,7-tetrahydroindol-2-yl]-2-(2-pyridinylthio)acetamide IUPAC Name: N-[3-cyano-1-(oxolan-2-ylmethyl)-4,5,6,7-tetrahydroindol-2-yl]-2-pyridin-2-ylsulfanylacetamide Traditional Name: N-[3-cyano-1-(tetrahydrofurfuryl)-4,5,6,7-tetrahydroindol-2-yl]-2-(2-pyridylthio)acetamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(N2CC3CCCO3)NC(=O)CSC4=CC=CC=N4)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(N2CC3CCCO3)NC(=O)CSC4=CC=CC=N4)C#N

InChI

InChI=1S/C21H24N4O2S/c22-12-17-16-7-1-2-8-18(16)25(13-15-6-5-11-27-15)21(17)24-19(26)14-28-20-9-3-4-10-23-20/h3-4,9-10,15H,1-2,5-8,11,13-14H2,(H,24,26)