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

Systemtic Name: N-[6-cyano-1-(1H-imidazol-5-ylmethyl)-3,4-dihydro-2H-quinolin-3-yl]-N-[(3-methylphenyl)methyl]benzenesulfonamide Openeye Name: N-[6-cyano-1-(1H-imidazol-5-ylmethyl)-3,4-dihydro-2H-quinolin-3-yl]-N-(m-tolylmethyl)benzenesulfonamide CAS Name: N-[6-cyano-1-(1H-imidazol-5-ylmethyl)-3,4-dihydro-2H-quinolin-3-yl]-N-[(3-methylphenyl)methyl]benzenesulfonamide IUPAC Name: N-[6-cyano-1-(1H-imidazol-5-ylmethyl)-3,4-dihydro-2H-quinolin-3-yl]-N-[(3-methylphenyl)methyl]benzenesulfonamide Traditional Name: N-[6-cyano-1-(1H-imidazol-5-ylmethyl)-3,4-dihydro-2H-quinolin-3-yl]-N-(3-methylbenzyl)benzenesulfonamide Formula: C28H27N5O2S MolecularWeight: 497.61128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN(C2CC3=C(C=CC(=C3)C#N)N(C2)CC4=CN=CN4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)CN(C2CC3=C(C=CC(=C3)C#N)N(C2)CC4=CN=CN4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H27N5O2S/c1-21-6-5-7-23(12-21)17-33(36(34,35)27-8-3-2-4-9-27)26-14-24-13-22(15-29)10-11-28(24)32(19-26)18-25-16-30-20-31-25/h2-13,16,20,26H,14,17-19H2,1H3,(H,30,31)