5-(4-bromophenyl)sulfonyl-N-[3-(pyridin-3-ylmethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide

Systemtic Name: 5-(4-bromophenyl)sulfonyl-N-[3-(pyridin-3-ylmethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide Openeye Name: 5-(4-bromophenyl)sulfonyl-N-[3-(3-pyridylmethylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]furan-2-carboxamide CAS Name: 5-(4-bromophenyl)sulfonyl-N-[3-[oxo-(3-pyridinylmethylamino)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-furancarboxamide IUPAC Name: 5-(4-bromophenyl)sulfonyl-N-[3-(pyridin-3-ylmethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide Traditional Name: 5-brosyl-N-[3-(3-pyridylmethylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-furamide Formula: C26H22BrN3O5S2 MolecularWeight: 600.50398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=C(O3)S(=O)(=O)C4=CC=C(C=C4)Br)C(=O)NCC5=CN=CC=C5

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=C(O3)S(=O)(=O)C4=CC=C(C=C4)Br)C(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C26H22BrN3O5S2/c27-17-7-9-18(10-8-17)37(33,34)22-12-11-20(35-22)24(31)30-26-23(19-5-1-2-6-21(19)36-26)25(32)29-15-16-4-3-13-28-14-16/h3-4,7-14H,1-2,5-6,15H2,(H,29,32)(H,30,31)