N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-2-oxidanylidene-3,4-dihydroquinolin-3-yl]-1-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]imidazole-4-sulfonamide

Systemtic Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-2-oxidanylidene-3,4-dihydroquinolin-3-yl]-1-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]imidazole-4-sulfonamide Openeye Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-2-oxo-3,4-dihydroquinolin-3-yl]-1-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]imidazole-4-sulfonamide CAS Name: N-[6-cyano-1-[(3-methyl-4-imidazolyl)methyl]-2-oxo-3,4-dihydroquinolin-3-yl]-1-methyl-N-[[4-(1-pyrazolyl)phenyl]methyl]-4-imidazolesulfonamide IUPAC Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-2-oxo-3,4-dihydroquinolin-3-yl]-1-methyl-N-[(4-pyrazol-1-ylphenyl)methyl]imidazole-4-sulfonamide Traditional Name: N-[6-cyano-2-keto-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydroquinolin-3-yl]-1-methyl-N-(4-pyrazol-1-ylbenzyl)imidazole-4-sulfonamide Formula: C29H27N9O3S MolecularWeight: 581.64818

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1)S(=O)(=O)N(CC2=CC=C(C=C2)N3C=CC=N3)C4CC5=C(C=CC(=C5)C#N)N(C4=O)CC6=CN=CN6C

Isomeric SMILES

CN1C=C(N=C1)S(=O)(=O)N(CC2=CC=C(C=C2)N3C=CC=N3)C4CC5=C(C=CC(=C5)C#N)N(C4=O)CC6=CN=CN6C

InChI

InChI=1S/C29H27N9O3S/c1-34-18-28(32-20-34)42(40,41)38(16-21-4-7-24(8-5-21)37-11-3-10-33-37)27-13-23-12-22(14-30)6-9-26(23)36(29(27)39)17-25-15-31-19-35(25)2/h3-12,15,18-20,27H,13,16-17H2,1-2H3