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

Systemtic Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-N-[(3-pyrrol-1-ylphenyl)methyl]pyridine-2-sulfonamide Openeye Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-N-[(3-pyrrol-1-ylphenyl)methyl]pyridine-2-sulfonamide CAS Name: N-[6-cyano-1-[(3-methyl-4-imidazolyl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-N-[[3-(1-pyrrolyl)phenyl]methyl]-2-pyridinesulfonamide IUPAC Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-N-[(3-pyrrol-1-ylphenyl)methyl]pyridine-2-sulfonamide Traditional Name: N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-N-(3-pyrrol-1-ylbenzyl)pyridine-2-sulfonamide Formula: C31H29N7O2S MolecularWeight: 563.67266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1CN2CC(CC3=C2C=CC(=C3)C#N)N(CC4=CC(=CC=C4)N5C=CC=C5)S(=O)(=O)C6=CC=CC=N6

Isomeric SMILES

CN1C=NC=C1CN2CC(CC3=C2C=CC(=C3)C#N)N(CC4=CC(=CC=C4)N5C=CC=C5)S(=O)(=O)C6=CC=CC=N6

InChI

InChI=1S/C31H29N7O2S/c1-35-23-33-19-29(35)22-37-21-28(17-26-15-24(18-32)10-11-30(26)37)38(41(39,40)31-9-2-3-12-34-31)20-25-7-6-8-27(16-25)36-13-4-5-14-36/h2-16,19,23,28H,17,20-22H2,1H3