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

Systemtic Name: N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-4-morpholin-4-ylsulfonyl-benzenesulfonamide Openeye Name: N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-4-morpholinosulfonyl-benzenesulfonamide CAS Name: N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-4-(4-morpholinylsulfonyl)benzenesulfonamide IUPAC Name: N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-4-morpholin-4-ylsulfonylbenzenesulfonamide Traditional Name: N-[(2,3-dimethyl-1H-indol-5-yl)methyl]-4-morpholinosulfonyl-benzenesulfonamide Formula: C21H25N3O5S2 MolecularWeight: 463.5703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)C

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)C

InChI

InChI=1S/C21H25N3O5S2/c1-15-16(2)23-21-8-3-17(13-20(15)21)14-22-30(25,26)18-4-6-19(7-5-18)31(27,28)24-9-11-29-12-10-24/h3-8,13,22-23H,9-12,14H2,1-2H3