N-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)-4-(3-methylbutyl)benzenesulfonamide

Systemtic Name: N-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)-4-(3-methylbutyl)benzenesulfonamide Openeye Name: 4-isopentyl-N-(4-methoxy-3-morpholinosulfonyl-phenyl)benzenesulfonamide CAS Name: N-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-4-(3-methylbutyl)benzenesulfonamide IUPAC Name: N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)-4-(3-methylbutyl)benzenesulfonamide Traditional Name: 4-isoamyl-N-(4-methoxy-3-morpholinosulfonyl-phenyl)benzenesulfonamide Formula: C22H30N2O6S2 MolecularWeight: 482.6134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)OC)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC(C)CCC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)OC)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C22H30N2O6S2/c1-17(2)4-5-18-6-9-20(10-7-18)31(25,26)23-19-8-11-21(29-3)22(16-19)32(27,28)24-12-14-30-15-13-24/h6-11,16-17,23H,4-5,12-15H2,1-3H3