2-imidazol-1-yl-N-[3-(2-methoxyphenyl)carbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]ethanamide

Systemtic Name: 2-imidazol-1-yl-N-[3-(2-methoxyphenyl)carbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]ethanamide Openeye Name: 2-imidazol-1-yl-N-[3-(2-methoxybenzoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]acetamide CAS Name: 2-(1-imidazolyl)-N-[3-[(2-methoxyphenyl)-oxomethyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]acetamide IUPAC Name: 2-imidazol-1-yl-N-[3-(2-methoxybenzoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]acetamide Traditional Name: 2-imidazol-1-yl-N-(3-o-anisoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)acetamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)C2=C(SC3=C2CCCC3)NC(=O)CN4C=CN=C4

Isomeric SMILES

COC1=CC=CC=C1C(=O)C2=C(SC3=C2CCCC3)NC(=O)CN4C=CN=C4

InChI

InChI=1S/C21H21N3O3S/c1-27-16-8-4-2-6-14(16)20(26)19-15-7-3-5-9-17(15)28-21(19)23-18(25)12-24-11-10-22-13-24/h2,4,6,8,10-11,13H,3,5,7,9,12H2,1H3,(H,23,25)