4-[[2,5-bis(chloranyl)phenyl]-methylsulfonyl-amino]-N-(4-bromanyl-3-methyl-phenyl)butanamide

Systemtic Name: 4-[[2,5-bis(chloranyl)phenyl]-methylsulfonyl-amino]-N-(4-bromanyl-3-methyl-phenyl)butanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-4-(2,5-dichloro-N-methylsulfonyl-anilino)butanamide CAS Name: N-(4-bromo-3-methylphenyl)-4-(2,5-dichloro-N-methylsulfonylanilino)butanamide IUPAC Name: N-(4-bromo-3-methylphenyl)-4-(2,5-dichloro-N-methylsulfonylanilino)butanamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-4-(2,5-dichloro-N-mesyl-anilino)butyramide Formula: C18H19BrCl2N2O3S MolecularWeight: 494.23006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CCCN(C2=C(C=CC(=C2)Cl)Cl)S(=O)(=O)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CCCN(C2=C(C=CC(=C2)Cl)Cl)S(=O)(=O)C)Br

InChI

InChI=1S/C18H19BrCl2N2O3S/c1-12-10-14(6-7-15(12)19)22-18(24)4-3-9-23(27(2,25)26)17-11-13(20)5-8-16(17)21/h5-8,10-11H,3-4,9H2,1-2H3,(H,22,24)