N-(7-cyano-2-ethyl-5-phenyl-3,4-dihydro-1H-isoquinolin-8-yl)-N-methylsulfonyl-methanesulfonamide

Systemtic Name: N-(7-cyano-2-ethyl-5-phenyl-3,4-dihydro-1H-isoquinolin-8-yl)-N-methylsulfonyl-methanesulfonamide Openeye Name: N-(7-cyano-2-ethyl-5-phenyl-3,4-dihydro-1H-isoquinolin-8-yl)-N-methylsulfonyl-methanesulfonamide CAS Name: N-(7-cyano-2-ethyl-5-phenyl-3,4-dihydro-1H-isoquinolin-8-yl)-N-methylsulfonylmethanesulfonamide IUPAC Name: N-(7-cyano-2-ethyl-5-phenyl-3,4-dihydro-1H-isoquinolin-8-yl)-N-methylsulfonylmethanesulfonamide Traditional Name: N-(7-cyano-2-ethyl-5-phenyl-3,4-dihydro-1H-isoquinolin-8-yl)-N-mesyl-methanesulfonamide Formula: C20H23N3O4S2 MolecularWeight: 433.54432

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC2=C(C=C(C(=C2C1)N(S(=O)(=O)C)S(=O)(=O)C)C#N)C3=CC=CC=C3

Isomeric SMILES

CCN1CCC2=C(C=C(C(=C2C1)N(S(=O)(=O)C)S(=O)(=O)C)C#N)C3=CC=CC=C3

InChI

InChI=1S/C20H23N3O4S2/c1-4-22-11-10-17-18(15-8-6-5-7-9-15)12-16(13-21)20(19(17)14-22)23(28(2,24)25)29(3,26)27/h5-9,12H,4,10-11,14H2,1-3H3