N-(2-cyanoethyl)-N-(2-pyridin-2-ylethyl)-2,3-dihydro-1-benzofuran-5-sulfonamide

Systemtic Name: N-(2-cyanoethyl)-N-(2-pyridin-2-ylethyl)-2,3-dihydro-1-benzofuran-5-sulfonamide Openeye Name: N-(2-cyanoethyl)-N-[2-(2-pyridyl)ethyl]-2,3-dihydrobenzofuran-5-sulfonamide CAS Name: N-(2-cyanoethyl)-N-[2-(2-pyridinyl)ethyl]-2,3-dihydrobenzofuran-5-sulfonamide IUPAC Name: N-(2-cyanoethyl)-N-(2-pyridin-2-ylethyl)-2,3-dihydro-1-benzofuran-5-sulfonamide Traditional Name: N-(2-cyanoethyl)-N-[2-(2-pyridyl)ethyl]coumaran-5-sulfonamide Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)S(=O)(=O)N(CCC#N)CCC3=CC=CC=N3

Isomeric SMILES

C1COC2=C1C=C(C=C2)S(=O)(=O)N(CCC#N)CCC3=CC=CC=N3

InChI

InChI=1S/C18H19N3O3S/c19-9-3-11-21(12-7-16-4-1-2-10-20-16)25(22,23)17-5-6-18-15(14-17)8-13-24-18/h1-2,4-6,10,14H,3,7-8,11-13H2