N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-N-(4-morpholin-4-ylsulfonylphenyl)methanesulfonamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-N-(4-morpholin-4-ylsulfonylphenyl)methanesulfonamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-N-(4-morpholinosulfonylphenyl)methanesulfonamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N-[4-(4-morpholinylsulfonyl)phenyl]methanesulfonamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N-(4-morpholin-4-ylsulfonylphenyl)methanesulfonamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]-N-(4-morpholinosulfonylphenyl)methanesulfonamide Formula: C22H27N3O6S2 MolecularWeight: 493.59628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)N1CCC2=CC=CC=C2C1)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CS(=O)(=O)N(CC(=O)N1CCC2=CC=CC=C2C1)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H27N3O6S2/c1-32(27,28)25(17-22(26)23-11-10-18-4-2-3-5-19(18)16-23)20-6-8-21(9-7-20)33(29,30)24-12-14-31-15-13-24/h2-9H,10-17H2,1H3