4-cyano-3-(3,4-dichlorophenyl)-5-morpholin-4-yl-N-(2-oxidanylbutyl)thiophene-2-carboxamide

Systemtic Name: 4-cyano-3-(3,4-dichlorophenyl)-5-morpholin-4-yl-N-(2-oxidanylbutyl)thiophene-2-carboxamide Openeye Name: 4-cyano-3-(3,4-dichlorophenyl)-N-(2-hydroxybutyl)-5-morpholino-thiophene-2-carboxamide CAS Name: 4-cyano-3-(3,4-dichlorophenyl)-N-(2-hydroxybutyl)-5-(4-morpholinyl)-2-thiophenecarboxamide IUPAC Name: 4-cyano-3-(3,4-dichlorophenyl)-N-(2-hydroxybutyl)-5-morpholin-4-ylthiophene-2-carboxamide Traditional Name: 4-cyano-3-(3,4-dichlorophenyl)-N-(2-hydroxybutyl)-5-morpholino-thiophene-2-carboxamide Formula: C20H21Cl2N3O3S MolecularWeight: 454.37004

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C1=C(C(=C(S1)N2CCOCC2)C#N)C3=CC(=C(C=C3)Cl)Cl)O

Isomeric SMILES

CCC(CNC(=O)C1=C(C(=C(S1)N2CCOCC2)C#N)C3=CC(=C(C=C3)Cl)Cl)O

InChI

InChI=1S/C20H21Cl2N3O3S/c1-2-13(26)11-24-19(27)18-17(12-3-4-15(21)16(22)9-12)14(10-23)20(29-18)25-5-7-28-8-6-25/h3-4,9,13,26H,2,5-8,11H2,1H3,(H,24,27)