N-(3-ethyl-2-morpholin-4-yl-pentyl)-2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide

Systemtic Name: N-(3-ethyl-2-morpholin-4-yl-pentyl)-2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: N-(3-ethyl-2-morpholino-pentyl)-2-[2-(3-methylanilino)-2-oxo-ethyl]sulfanyl-acetamide CAS Name: N-[3-ethyl-2-(4-morpholinyl)pentyl]-2-[[2-(3-methylanilino)-2-oxoethyl]thio]acetamide IUPAC Name: N-(3-ethyl-2-morpholin-4-ylpentyl)-2-[2-(3-methylanilino)-2-oxoethyl]sulfanylacetamide Traditional Name: N-(3-ethyl-2-morpholino-pentyl)-2-[[2-keto-2-(m-toluidino)ethyl]thio]acetamide Formula: C22H35N3O3S MolecularWeight: 421.5966

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(CNC(=O)CSCC(=O)NC1=CC=CC(=C1)C)N2CCOCC2

Isomeric SMILES

CCC(CC)C(CNC(=O)CSCC(=O)NC1=CC=CC(=C1)C)N2CCOCC2

InChI

InChI=1S/C22H35N3O3S/c1-4-18(5-2)20(25-9-11-28-12-10-25)14-23-21(26)15-29-16-22(27)24-19-8-6-7-17(3)13-19/h6-8,13,18,20H,4-5,9-12,14-16H2,1-3H3,(H,23,26)(H,24,27)