N-(2-methoxyethyl)-2-[2-(phenylmethylsulfanyl)ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-(2-methoxyethyl)-2-[2-(phenylmethylsulfanyl)ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[(2-benzylsulfanylacetyl)amino]-N-(2-methoxyethyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-(2-methoxyethyl)-2-[[1-oxo-2-(phenylmethylthio)ethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[(2-benzylsulfanylacetyl)amino]-N-(2-methoxyethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[[2-(benzylthio)acetyl]amino]-N-(2-methoxyethyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C1=C(SC2=C1CCCC2)NC(=O)CSCC3=CC=CC=C3

Isomeric SMILES

COCCNC(=O)C1=C(SC2=C1CCCC2)NC(=O)CSCC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O3S2/c1-26-12-11-22-20(25)19-16-9-5-6-10-17(16)28-21(19)23-18(24)14-27-13-15-7-3-2-4-8-15/h2-4,7-8H,5-6,9-14H2,1H3,(H,22,25)(H,23,24)