N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-N-[(4-ethylsulfonylphenyl)methyl]-1-methyl-imidazole-4-sulfonamide

Systemtic Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-N-[(4-ethylsulfonylphenyl)methyl]-1-methyl-imidazole-4-sulfonamide Openeye Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-N-[(4-ethylsulfonylphenyl)methyl]-1-methyl-imidazole-4-sulfonamide CAS Name: N-[6-cyano-1-[(3-methyl-4-imidazolyl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-N-[(4-ethylsulfonylphenyl)methyl]-1-methyl-4-imidazolesulfonamide IUPAC Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-N-[(4-ethylsulfonylphenyl)methyl]-1-methylimidazole-4-sulfonamide Traditional Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-N-(4-esylbenzyl)-1-methyl-imidazole-4-sulfonamide Formula: C28H31N7O4S2 MolecularWeight: 593.72024

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)CN(C2CC3=C(C=CC(=C3)C#N)N(C2)CC4=CN=CN4C)S(=O)(=O)C5=CN(C=N5)C

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)CN(C2CC3=C(C=CC(=C3)C#N)N(C2)CC4=CN=CN4C)S(=O)(=O)C5=CN(C=N5)C

InChI

InChI=1S/C28H31N7O4S2/c1-4-40(36,37)26-8-5-21(6-9-26)15-35(41(38,39)28-18-32(2)20-31-28)24-12-23-11-22(13-29)7-10-27(23)34(16-24)17-25-14-30-19-33(25)3/h5-11,14,18-20,24H,4,12,15-17H2,1-3H3