N-[(4-dimethylaminophenyl)methyl]-N-ethyl-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-N-ethyl-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide Openeye Name: N-[(4-dimethylaminophenyl)methyl]-N-ethyl-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide CAS Name: N-[(4-dimethylaminophenyl)methyl]-N-ethyl-4-(1-pyrrolidinylsulfonyl)benzenesulfonamide IUPAC Name: N-[(4-dimethylaminophenyl)methyl]-N-ethyl-4-pyrrolidin-1-ylsulfonylbenzenesulfonamide Traditional Name: N-[4-(dimethylamino)benzyl]-N-ethyl-4-pyrrolidinosulfonyl-benzenesulfonamide Formula: C21H29N3O4S2 MolecularWeight: 451.60266

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(C=C1)N(C)C)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCN(CC1=CC=C(C=C1)N(C)C)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H29N3O4S2/c1-4-23(17-18-7-9-19(10-8-18)22(2)3)29(25,26)20-11-13-21(14-12-20)30(27,28)24-15-5-6-16-24/h7-14H,4-6,15-17H2,1-3H3