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

Systemtic Name: 3-methylsulfanyl-N-[(5-pyridin-3-yl-2,3-dihydro-1-benzofuran-2-yl)methyl]propanamide Openeye Name: 3-methylsulfanyl-N-[[5-(3-pyridyl)-2,3-dihydrobenzofuran-2-yl]methyl]propanamide CAS Name: 3-(methylthio)-N-[[5-(3-pyridinyl)-2,3-dihydrobenzofuran-2-yl]methyl]propanamide IUPAC Name: 3-methylsulfanyl-N-[(5-pyridin-3-yl-2,3-dihydro-1-benzofuran-2-yl)methyl]propanamide Traditional Name: 3-(methylthio)-N-[[5-(3-pyridyl)coumaran-2-yl]methyl]propionamide Formula: C18H20N2O2S MolecularWeight: 328.4286

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(=O)NCC1CC2=C(O1)C=CC(=C2)C3=CN=CC=C3

Isomeric SMILES

CSCCC(=O)NCC1CC2=C(O1)C=CC(=C2)C3=CN=CC=C3

InChI

InChI=1S/C18H20N2O2S/c1-23-8-6-18(21)20-12-16-10-15-9-13(4-5-17(15)22-16)14-3-2-7-19-11-14/h2-5,7,9,11,16H,6,8,10,12H2,1H3,(H,20,21)