2,5-bis(chloranyl)-3,6-dimethyl-N-(4-pyrrolidin-1-ylcarbonylphenyl)benzenesulfonamide

Systemtic Name: 2,5-bis(chloranyl)-3,6-dimethyl-N-(4-pyrrolidin-1-ylcarbonylphenyl)benzenesulfonamide Openeye Name: 2,5-dichloro-3,6-dimethyl-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzenesulfonamide CAS Name: 2,5-dichloro-3,6-dimethyl-N-[4-[oxo(1-pyrrolidinyl)methyl]phenyl]benzenesulfonamide IUPAC Name: 2,5-dichloro-3,6-dimethyl-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzenesulfonamide Traditional Name: 2,5-dichloro-3,6-dimethyl-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzenesulfonamide Formula: C19H20Cl2N2O3S MolecularWeight: 427.3447

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1Cl)S(=O)(=O)NC2=CC=C(C=C2)C(=O)N3CCCC3)C)Cl

Isomeric SMILES

CC1=CC(=C(C(=C1Cl)S(=O)(=O)NC2=CC=C(C=C2)C(=O)N3CCCC3)C)Cl

InChI

InChI=1S/C19H20Cl2N2O3S/c1-12-11-16(20)13(2)18(17(12)21)27(25,26)22-15-7-5-14(6-8-15)19(24)23-9-3-4-10-23/h5-8,11,22H,3-4,9-10H2,1-2H3