N-(2-methylphenyl)-2-(2-morpholin-4-ylethanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-(2-methylphenyl)-2-(2-morpholin-4-ylethanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[(2-morpholinoacetyl)amino]-N-(o-tolyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-(2-methylphenyl)-2-[[2-(4-morpholinyl)-1-oxoethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-(2-methylphenyl)-2-[(2-morpholin-4-ylacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[(2-morpholinoacetyl)amino]-N-(o-tolyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=C(SC3=C2CCCC3)NC(=O)CN4CCOCC4

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=C(SC3=C2CCCC3)NC(=O)CN4CCOCC4

InChI

InChI=1S/C22H27N3O3S/c1-15-6-2-4-8-17(15)23-21(27)20-16-7-3-5-9-18(16)29-22(20)24-19(26)14-25-10-12-28-13-11-25/h2,4,6,8H,3,5,7,9-14H2,1H3,(H,23,27)(H,24,26)