N-(2-ethoxyphenyl)-2-(pyridin-3-ylmethylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-(2-ethoxyphenyl)-2-(pyridin-3-ylmethylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-(2-ethoxyphenyl)-2-(3-pyridylmethylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-(2-ethoxyphenyl)-2-(3-pyridinylmethylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-(2-ethoxyphenyl)-2-(pyridin-3-ylmethylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-o-phenetyl-2-(3-pyridylmethylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C2=C(SC3=C2CCCC3)NCC4=CN=CC=C4

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)C2=C(SC3=C2CCCC3)NCC4=CN=CC=C4

InChI

InChI=1S/C23H25N3O2S/c1-2-28-19-11-5-4-10-18(19)26-22(27)21-17-9-3-6-12-20(17)29-23(21)25-15-16-8-7-13-24-14-16/h4-5,7-8,10-11,13-14,25H,2-3,6,9,12,15H2,1H3,(H,26,27)