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

Systemtic Name: N-[(7-pyrazin-2-yl-2,3-dihydro-1-benzofuran-2-yl)methyl]-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxamide Openeye Name: N-[(7-pyrazin-2-yl-2,3-dihydrobenzofuran-2-yl)methyl]-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxamide CAS Name: N-[[7-(2-pyrazinyl)-2,3-dihydrobenzofuran-2-yl]methyl]-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxamide IUPAC Name: N-[(7-pyrazin-2-yl-2,3-dihydro-1-benzofuran-2-yl)methyl]-4,5,6,7-tetrahydro-2-benzothiophene-1-carboxamide Traditional Name: N-[(7-pyrazin-2-ylcoumaran-2-yl)methyl]-4,5,6,7-tetrahydroisobenzothiophene-1-carboxamide Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(SC=C2C1)C(=O)NCC3CC4=CC=CC(=C4O3)C5=NC=CN=C5

Isomeric SMILES

C1CCC2=C(SC=C2C1)C(=O)NCC3CC4=CC=CC(=C4O3)C5=NC=CN=C5

InChI

InChI=1S/C22H21N3O2S/c26-22(21-17-6-2-1-4-15(17)13-28-21)25-11-16-10-14-5-3-7-18(20(14)27-16)19-12-23-8-9-24-19/h3,5,7-9,12-13,16H,1-2,4,6,10-11H2,(H,25,26)