2-[2-(5-propan-2-yl-1-benzofuran-3-yl)ethanoylamino]-N-(pyridin-3-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[2-(5-propan-2-yl-1-benzofuran-3-yl)ethanoylamino]-N-(pyridin-3-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[[2-(5-isopropylbenzofuran-3-yl)acetyl]amino]-N-(3-pyridylmethyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[1-oxo-2-(5-propan-2-yl-3-benzofuranyl)ethyl]amino]-N-(3-pyridinylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[[2-(5-propan-2-yl-1-benzofuran-3-yl)acetyl]amino]-N-(pyridin-3-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[[2-(5-isopropylbenzofuran-3-yl)acetyl]amino]-N-(3-pyridylmethyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C28H29N3O3S MolecularWeight: 487.61316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)OC=C2CC(=O)NC3=C(C4=C(S3)CCCC4)C(=O)NCC5=CN=CC=C5

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)OC=C2CC(=O)NC3=C(C4=C(S3)CCCC4)C(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C28H29N3O3S/c1-17(2)19-9-10-23-22(12-19)20(16-34-23)13-25(32)31-28-26(21-7-3-4-8-24(21)35-28)27(33)30-15-18-6-5-11-29-14-18/h5-6,9-12,14,16-17H,3-4,7-8,13,15H2,1-2H3,(H,30,33)(H,31,32)