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

Systemtic Name: 3,5,7-trimethyl-N-[3-(pyridin-3-ylmethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1-benzofuran-2-carboxamide Openeye Name: 3,5,7-trimethyl-N-[3-(3-pyridylmethylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]benzofuran-2-carboxamide CAS Name: 3,5,7-trimethyl-N-[3-[oxo-(3-pyridinylmethylamino)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-benzofurancarboxamide IUPAC Name: 3,5,7-trimethyl-N-[3-(pyridin-3-ylmethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1-benzofuran-2-carboxamide Traditional Name: 3,5,7-trimethyl-N-[3-(3-pyridylmethylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]coumarilamide Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=C(O2)C(=O)NC3=C(C4=C(S3)CCCC4)C(=O)NCC5=CN=CC=C5)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=C(O2)C(=O)NC3=C(C4=C(S3)CCCC4)C(=O)NCC5=CN=CC=C5)C)C

InChI

InChI=1S/C27H27N3O3S/c1-15-11-16(2)23-20(12-15)17(3)24(33-23)26(32)30-27-22(19-8-4-5-9-21(19)34-27)25(31)29-14-18-7-6-10-28-13-18/h6-7,10-13H,4-5,8-9,14H2,1-3H3,(H,29,31)(H,30,32)