2-phenylsulfanyl-N-[(5-pyridin-3-yl-2,3-dihydro-1-benzofuran-2-yl)methyl]ethanamide

Systemtic Name: 2-phenylsulfanyl-N-[(5-pyridin-3-yl-2,3-dihydro-1-benzofuran-2-yl)methyl]ethanamide Openeye Name: 2-phenylsulfanyl-N-[[5-(3-pyridyl)-2,3-dihydrobenzofuran-2-yl]methyl]acetamide CAS Name: 2-(phenylthio)-N-[[5-(3-pyridinyl)-2,3-dihydrobenzofuran-2-yl]methyl]acetamide IUPAC Name: 2-phenylsulfanyl-N-[(5-pyridin-3-yl-2,3-dihydro-1-benzofuran-2-yl)methyl]acetamide Traditional Name: 2-(phenylthio)-N-[[5-(3-pyridyl)coumaran-2-yl]methyl]acetamide Formula: C22H20N2O2S MolecularWeight: 376.4714

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C1C=C(C=C2)C3=CN=CC=C3)CNC(=O)CSC4=CC=CC=C4

Isomeric SMILES

C1C(OC2=C1C=C(C=C2)C3=CN=CC=C3)CNC(=O)CSC4=CC=CC=C4

InChI

InChI=1S/C22H20N2O2S/c25-22(15-27-20-6-2-1-3-7-20)24-14-19-12-18-11-16(8-9-21(18)26-19)17-5-4-10-23-13-17/h1-11,13,19H,12,14-15H2,(H,24,25)