N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-2-oxidanylidene-3,4-dihydroquinolin-3-yl]-N-[(4-methylsulfonylphenyl)methyl]pyridine-2-sulfonamide

Systemtic Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-2-oxidanylidene-3,4-dihydroquinolin-3-yl]-N-[(4-methylsulfonylphenyl)methyl]pyridine-2-sulfonamide Openeye Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-2-oxo-3,4-dihydroquinolin-3-yl]-N-[(4-methylsulfonylphenyl)methyl]pyridine-2-sulfonamide CAS Name: N-[6-cyano-1-[(3-methyl-4-imidazolyl)methyl]-2-oxo-3,4-dihydroquinolin-3-yl]-N-[(4-methylsulfonylphenyl)methyl]-2-pyridinesulfonamide IUPAC Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-2-oxo-3,4-dihydroquinolin-3-yl]-N-[(4-methylsulfonylphenyl)methyl]pyridine-2-sulfonamide Traditional Name: N-[6-cyano-2-keto-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydroquinolin-3-yl]-N-(4-mesylbenzyl)pyridine-2-sulfonamide Formula: C28H26N6O5S2 MolecularWeight: 590.67324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1CN2C3=C(CC(C2=O)N(CC4=CC=C(C=C4)S(=O)(=O)C)S(=O)(=O)C5=CC=CC=N5)C=C(C=C3)C#N

Isomeric SMILES

CN1C=NC=C1CN2C3=C(CC(C2=O)N(CC4=CC=C(C=C4)S(=O)(=O)C)S(=O)(=O)C5=CC=CC=N5)C=C(C=C3)C#N

InChI

InChI=1S/C28H26N6O5S2/c1-32-19-30-16-23(32)18-33-25-11-8-21(15-29)13-22(25)14-26(28(33)35)34(41(38,39)27-5-3-4-12-31-27)17-20-6-9-24(10-7-20)40(2,36)37/h3-13,16,19,26H,14,17-18H2,1-2H3