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

Systemtic Name: 4-[[2,5-bis(chloranyl)phenyl]-methylsulfonyl-amino]-N-(3-prop-2-enoxyphenyl)butanamide Openeye Name: N-(3-allyloxyphenyl)-4-(2,5-dichloro-N-methylsulfonyl-anilino)butanamide CAS Name: 4-(2,5-dichloro-N-methylsulfonylanilino)-N-(3-prop-2-enoxyphenyl)butanamide IUPAC Name: 4-(2,5-dichloro-N-methylsulfonylanilino)-N-(3-prop-2-enoxyphenyl)butanamide Traditional Name: N-(3-allyloxyphenyl)-4-(2,5-dichloro-N-mesyl-anilino)butyramide Formula: C20H22Cl2N2O4S MolecularWeight: 457.37068

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCC(=O)NC1=CC(=CC=C1)OCC=C)C2=C(C=CC(=C2)Cl)Cl

Isomeric SMILES

CS(=O)(=O)N(CCCC(=O)NC1=CC(=CC=C1)OCC=C)C2=C(C=CC(=C2)Cl)Cl

InChI

InChI=1S/C20H22Cl2N2O4S/c1-3-12-28-17-7-4-6-16(14-17)23-20(25)8-5-11-24(29(2,26)27)19-13-15(21)9-10-18(19)22/h3-4,6-7,9-10,13-14H,1,5,8,11-12H2,2H3,(H,23,25)