4-[(2R)-2-[(2-pyridin-4-ylsulfanylethanoylamino)methyl]-2,3-dihydro-1-benzofuran-7-yl]benzamide

Systemtic Name: 4-[(2R)-2-[(2-pyridin-4-ylsulfanylethanoylamino)methyl]-2,3-dihydro-1-benzofuran-7-yl]benzamide Openeye Name: 4-[(2R)-2-[[[2-(4-pyridylsulfanyl)acetyl]amino]methyl]-2,3-dihydrobenzofuran-7-yl]benzamide CAS Name: 4-[(2R)-2-[[[1-oxo-2-(pyridin-4-ylthio)ethyl]amino]methyl]-2,3-dihydrobenzofuran-7-yl]benzamide IUPAC Name: 4-[(2R)-2-[[(2-pyridin-4-ylsulfanylacetyl)amino]methyl]-2,3-dihydro-1-benzofuran-7-yl]benzamide Traditional Name: 4-[(2R)-2-[[[2-(4-pyridylthio)acetyl]amino]methyl]coumaran-7-yl]benzamide Formula: C23H21N3O3S MolecularWeight: 419.49614

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C(C=CC=C21)C3=CC=C(C=C3)C(=O)N)CNC(=O)CSC4=CC=NC=C4

Isomeric SMILES

C1[C@@H](OC2=C(C=CC=C21)C3=CC=C(C=C3)C(=O)N)CNC(=O)CSC4=CC=NC=C4

InChI

InChI=1S/C23H21N3O3S/c24-23(28)16-6-4-15(5-7-16)20-3-1-2-17-12-18(29-22(17)20)13-26-21(27)14-30-19-8-10-25-11-9-19/h1-11,18H,12-14H2,(H2,24,28)(H,26,27)/t18-/m1/s1