N-[[(2R)-7-pyridin-4-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-[[(2R)-7-pyridin-4-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-[[(2R)-7-(4-pyridyl)-2,3-dihydrobenzofuran-2-yl]methyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-[[(2R)-7-pyridin-4-yl-2,3-dihydrobenzofuran-2-yl]methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-[[(2R)-7-pyridin-4-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-[[(2R)-7-(4-pyridyl)coumaran-2-yl]methyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C23H22N2O2S MolecularWeight: 390.49798

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=CS2)C(=O)NCC3CC4=CC=CC(=C4O3)C5=CC=NC=C5

Isomeric SMILES

C1CCC2=C(C1)C(=CS2)C(=O)NC[C@H]3CC4=CC=CC(=C4O3)C5=CC=NC=C5

InChI

InChI=1S/C23H22N2O2S/c26-23(20-14-28-21-7-2-1-5-19(20)21)25-13-17-12-16-4-3-6-18(22(16)27-17)15-8-10-24-11-9-15/h3-4,6,8-11,14,17H,1-2,5,7,12-13H2,(H,25,26)/t17-/m1/s1