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

Systemtic Name: N-(2-methylphenyl)-2-(2-pyrrolidin-1-ylethanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-(o-tolyl)-2-[(2-pyrrolidin-1-ylacetyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-(2-methylphenyl)-2-[[1-oxo-2-(1-pyrrolidinyl)ethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-(2-methylphenyl)-2-[(2-pyrrolidin-1-ylacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-(o-tolyl)-2-[(2-pyrrolidinoacetyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=C(SC3=C2CCCC3)NC(=O)CN4CCCC4

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=C(SC3=C2CCCC3)NC(=O)CN4CCCC4

InChI

InChI=1S/C22H27N3O2S/c1-15-8-2-4-10-17(15)23-21(27)20-16-9-3-5-11-18(16)28-22(20)24-19(26)14-25-12-6-7-13-25/h2,4,8,10H,3,5-7,9,11-14H2,1H3,(H,23,27)(H,24,26)