N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-N-[(4-cyanophenyl)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-cyanophenyl)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-cyanophenyl)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-cyanophenyl)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-cyanophenyl)methyl]-1-methylimidazole-4-sulfonamide Traditional Name: N-(4-cyanobenzyl)-N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-1-methyl-imidazole-4-sulfonamide Formula: C27H26N8O2S MolecularWeight: 526.61274

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1)S(=O)(=O)N(CC2=CC=C(C=C2)C#N)C3CC4=C(C=CC(=C4)C#N)N(C3)CC5=CN=CN5C

Isomeric SMILES

CN1C=C(N=C1)S(=O)(=O)N(CC2=CC=C(C=C2)C#N)C3CC4=C(C=CC(=C4)C#N)N(C3)CC5=CN=CN5C

InChI

InChI=1S/C27H26N8O2S/c1-32-17-27(31-19-32)38(36,37)35(14-21-5-3-20(11-28)4-6-21)24-10-23-9-22(12-29)7-8-26(23)34(15-24)16-25-13-30-18-33(25)2/h3-9,13,17-19,24H,10,14-16H2,1-2H3