N-[6-cyano-1-(1H-imidazol-5-ylmethyl)-3,4-dihydro-2H-quinolin-3-yl]-N-[(2-ethoxyphenyl)methyl]benzenesulfonamide

Systemtic Name: N-[6-cyano-1-(1H-imidazol-5-ylmethyl)-3,4-dihydro-2H-quinolin-3-yl]-N-[(2-ethoxyphenyl)methyl]benzenesulfonamide Openeye Name: N-[6-cyano-1-(1H-imidazol-5-ylmethyl)-3,4-dihydro-2H-quinolin-3-yl]-N-[(2-ethoxyphenyl)methyl]benzenesulfonamide CAS Name: N-[6-cyano-1-(1H-imidazol-5-ylmethyl)-3,4-dihydro-2H-quinolin-3-yl]-N-[(2-ethoxyphenyl)methyl]benzenesulfonamide IUPAC Name: N-[6-cyano-1-(1H-imidazol-5-ylmethyl)-3,4-dihydro-2H-quinolin-3-yl]-N-[(2-ethoxyphenyl)methyl]benzenesulfonamide Traditional Name: N-[6-cyano-1-(1H-imidazol-5-ylmethyl)-3,4-dihydro-2H-quinolin-3-yl]-N-(2-ethoxybenzyl)benzenesulfonamide Formula: C29H29N5O3S MolecularWeight: 527.63726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CN(C2CC3=C(C=CC(=C3)C#N)N(C2)CC4=CN=CN4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=CC=C1CN(C2CC3=C(C=CC(=C3)C#N)N(C2)CC4=CN=CN4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C29H29N5O3S/c1-2-37-29-11-7-6-8-23(29)18-34(38(35,36)27-9-4-3-5-10-27)26-15-24-14-22(16-30)12-13-28(24)33(20-26)19-25-17-31-21-32-25/h3-14,17,21,26H,2,15,18-20H2,1H3,(H,31,32)