N-[3-(butylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[3-(butylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1-benzofuran-2-carboxamide Openeye Name: N-[3-(butylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]benzofuran-2-carboxamide CAS Name: N-[3-[butylamino(oxo)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-benzofurancarboxamide IUPAC Name: N-[3-(butylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1-benzofuran-2-carboxamide Traditional Name: N-[3-(butylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]coumarilamide Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CCCCNC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C22H24N2O3S/c1-2-3-12-23-21(26)19-15-9-5-7-11-18(15)28-22(19)24-20(25)17-13-14-8-4-6-10-16(14)27-17/h4,6,8,10,13H,2-3,5,7,9,11-12H2,1H3,(H,23,26)(H,24,25)