4-[[2,5-bis(chloranyl)phenyl]-methylsulfonyl-amino]-N-(4-methoxyphenyl)butanamide

Systemtic Name: 4-[[2,5-bis(chloranyl)phenyl]-methylsulfonyl-amino]-N-(4-methoxyphenyl)butanamide Openeye Name: 4-(2,5-dichloro-N-methylsulfonyl-anilino)-N-(4-methoxyphenyl)butanamide CAS Name: 4-(2,5-dichloro-N-methylsulfonylanilino)-N-(4-methoxyphenyl)butanamide IUPAC Name: 4-(2,5-dichloro-N-methylsulfonylanilino)-N-(4-methoxyphenyl)butanamide Traditional Name: 4-(2,5-dichloro-N-mesyl-anilino)-N-(4-methoxyphenyl)butyramide Formula: C18H20Cl2N2O4S MolecularWeight: 431.3334

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CCCN(C2=C(C=CC(=C2)Cl)Cl)S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CCCN(C2=C(C=CC(=C2)Cl)Cl)S(=O)(=O)C

InChI

InChI=1S/C18H20Cl2N2O4S/c1-26-15-8-6-14(7-9-15)21-18(23)4-3-11-22(27(2,24)25)17-12-13(19)5-10-16(17)20/h5-10,12H,3-4,11H2,1-2H3,(H,21,23)