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

Systemtic Name: 4-[[2,5-bis(chloranyl)phenyl]-methylsulfonyl-amino]-N-(4-butylphenyl)butanamide Openeye Name: N-(4-butylphenyl)-4-(2,5-dichloro-N-methylsulfonyl-anilino)butanamide CAS Name: N-(4-butylphenyl)-4-(2,5-dichloro-N-methylsulfonylanilino)butanamide IUPAC Name: N-(4-butylphenyl)-4-(2,5-dichloro-N-methylsulfonylanilino)butanamide Traditional Name: N-(4-butylphenyl)-4-(2,5-dichloro-N-mesyl-anilino)butyramide Formula: C21H26Cl2N2O3S MolecularWeight: 457.41374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CCCN(C2=C(C=CC(=C2)Cl)Cl)S(=O)(=O)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CCCN(C2=C(C=CC(=C2)Cl)Cl)S(=O)(=O)C

InChI

InChI=1S/C21H26Cl2N2O3S/c1-3-4-6-16-8-11-18(12-9-16)24-21(26)7-5-14-25(29(2,27)28)20-15-17(22)10-13-19(20)23/h8-13,15H,3-7,14H2,1-2H3,(H,24,26)