3-[6-[2-(aminocarbonylamino)ethanoyl]-5-azanyl-4-methoxy-2-methyl-3-phenylmethoxy-quinolin-7-yl]-N-pyridin-4-yl-benzamide dihydrochloride

Systemtic Name: 3-[6-[2-(aminocarbonylamino)ethanoyl]-5-azanyl-4-methoxy-2-methyl-3-phenylmethoxy-quinolin-7-yl]-N-pyridin-4-yl-benzamide dihydrochloride Openeye Name: 3-(5-amino-3-benzyloxy-6-hydantoyl-4-methoxy-2-methyl-7-quinolyl)-N-(4-pyridyl)benzamide dihydrochloride CAS Name: 3-[5-amino-6-[2-(carbamoylamino)-1-oxoethyl]-4-methoxy-2-methyl-3-phenylmethoxy-7-quinolinyl]-N-pyridin-4-ylbenzamide dihydrochloride IUPAC Name: 3-[5-amino-6-[2-(carbamoylamino)acetyl]-4-methoxy-2-methyl-3-phenylmethoxyquinolin-7-yl]-N-pyridin-4-ylbenzamide dihydrochloride Traditional Name: 3-(5-amino-3-benzoxy-6-hydantoyl-4-methoxy-2-methyl-7-quinolyl)-N-(4-pyridyl)benzamide dihydrochloride Formula: C33H32Cl2N6O5 MolecularWeight: 663.55038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=C(C(=C2)C3=CC(=CC=C3)C(=O)NC4=CC=NC=C4)C(=O)CNC(=O)N)N)C(=C1OCC5=CC=CC=C5)OC.Cl.Cl

Isomeric SMILES

CC1=NC2=C(C(=C(C(=C2)C3=CC(=CC=C3)C(=O)NC4=CC=NC=C4)C(=O)CNC(=O)N)N)C(=C1OCC5=CC=CC=C5)OC.Cl.Cl

InChI

InChI=1S/C33H30N6O5.2ClH/c1-19-30(44-18-20-7-4-3-5-8-20)31(43-2)28-25(38-19)16-24(27(29(28)34)26(40)17-37-33(35)42)21-9-6-10-22(15-21)32(41)39-23-11-13-36-14-12-23;;/h3-16H,17-18,34H2,1-2H3,(H3,35,37,42)(H,36,39,41);2*1H