N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-N-[(4-methylsulfonylphenyl)methyl]benzenesulfonamide

Systemtic Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-N-[(4-methylsulfonylphenyl)methyl]benzenesulfonamide Openeye Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-N-[(4-methylsulfonylphenyl)methyl]benzenesulfonamide CAS Name: N-[6-cyano-1-[(3-methyl-4-imidazolyl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-N-[(4-methylsulfonylphenyl)methyl]benzenesulfonamide IUPAC Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-N-[(4-methylsulfonylphenyl)methyl]benzenesulfonamide Traditional Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-N-(4-mesylbenzyl)benzenesulfonamide Formula: C29H29N5O4S2 MolecularWeight: 575.70166

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1CN2CC(CC3=C2C=CC(=C3)C#N)N(CC4=CC=C(C=C4)S(=O)(=O)C)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CN1C=NC=C1CN2CC(CC3=C2C=CC(=C3)C#N)N(CC4=CC=C(C=C4)S(=O)(=O)C)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C29H29N5O4S2/c1-32-21-31-17-26(32)20-33-19-25(15-24-14-23(16-30)10-13-29(24)33)34(40(37,38)28-6-4-3-5-7-28)18-22-8-11-27(12-9-22)39(2,35)36/h3-14,17,21,25H,15,18-20H2,1-2H3