4-[2,4-bis(chloranyl)phenoxy]-N-(3-cyano-4-methyl-5-morpholin-4-ylcarbonyl-thiophen-2-yl)butanamide

Systemtic Name: 4-[2,4-bis(chloranyl)phenoxy]-N-(3-cyano-4-methyl-5-morpholin-4-ylcarbonyl-thiophen-2-yl)butanamide Openeye Name: N-[3-cyano-4-methyl-5-(morpholine-4-carbonyl)-2-thienyl]-4-(2,4-dichlorophenoxy)butanamide CAS Name: N-[3-cyano-4-methyl-5-[4-morpholinyl(oxo)methyl]-2-thiophenyl]-4-(2,4-dichlorophenoxy)butanamide IUPAC Name: N-[3-cyano-4-methyl-5-(morpholine-4-carbonyl)thiophen-2-yl]-4-(2,4-dichlorophenoxy)butanamide Traditional Name: N-[3-cyano-4-methyl-5-(morpholine-4-carbonyl)-2-thienyl]-4-(2,4-dichlorophenoxy)butyramide Formula: C21H21Cl2N3O4S MolecularWeight: 482.38014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl)C(=O)N3CCOCC3

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl)C(=O)N3CCOCC3

InChI

InChI=1S/C21H21Cl2N3O4S/c1-13-15(12-24)20(31-19(13)21(28)26-6-9-29-10-7-26)25-18(27)3-2-8-30-17-5-4-14(22)11-16(17)23/h4-5,11H,2-3,6-10H2,1H3,(H,25,27)