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

Systemtic Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-1-methyl-N-(2-thiophen-2-ylethyl)imidazole-4-sulfonamide Openeye Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-1-methyl-N-[2-(2-thienyl)ethyl]imidazole-4-sulfonamide CAS Name: N-[6-cyano-1-[(3-methyl-4-imidazolyl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-1-methyl-N-(2-thiophen-2-ylethyl)-4-imidazolesulfonamide IUPAC Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-1-methyl-N-(2-thiophen-2-ylethyl)imidazole-4-sulfonamide Traditional Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-1-methyl-N-[2-(2-thienyl)ethyl]imidazole-4-sulfonamide Formula: C25H27N7O2S2 MolecularWeight: 521.65758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1)S(=O)(=O)N(CCC2=CC=CS2)C3CC4=C(C=CC(=C4)C#N)N(C3)CC5=CN=CN5C

Isomeric SMILES

CN1C=C(N=C1)S(=O)(=O)N(CCC2=CC=CS2)C3CC4=C(C=CC(=C4)C#N)N(C3)CC5=CN=CN5C

InChI

InChI=1S/C25H27N7O2S2/c1-29-16-25(28-18-29)36(33,34)32(8-7-23-4-3-9-35-23)21-11-20-10-19(12-26)5-6-24(20)31(14-21)15-22-13-27-17-30(22)2/h3-6,9-10,13,16-18,21H,7-8,11,14-15H2,1-2H3