N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide

Systemtic Name: N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide Openeye Name: N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide CAS Name: N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-4-(1-pyrrolidinylsulfonyl)benzenesulfonamide IUPAC Name: N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-4-pyrrolidin-1-ylsulfonylbenzenesulfonamide Traditional Name: N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-4-pyrrolidinosulfonyl-benzenesulfonamide Formula: C21H25N3O4S2 MolecularWeight: 447.5709

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4)C

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4)C

InChI

InChI=1S/C21H25N3O4S2/c1-15-16(2)23-21-10-5-17(13-20(15)21)14-22-29(25,26)18-6-8-19(9-7-18)30(27,28)24-11-3-4-12-24/h5-10,13,22-23H,3-4,11-12,14H2,1-2H3