1-[2-[4-azanyl-2-methyl-3-phenylmethoxy-6-[3-(4-phenylpiperazin-1-yl)carbonylphenyl]quinolin-5-yl]-2-oxidanylidene-ethyl]urea

Systemtic Name: 1-[2-[4-azanyl-2-methyl-3-phenylmethoxy-6-[3-(4-phenylpiperazin-1-yl)carbonylphenyl]quinolin-5-yl]-2-oxidanylidene-ethyl]urea Openeye Name: [2-[4-amino-3-benzyloxy-2-methyl-6-[3-(4-phenylpiperazine-1-carbonyl)phenyl]-5-quinolyl]-2-oxo-ethyl]urea CAS Name: [2-[4-amino-2-methyl-6-[3-[oxo-(4-phenyl-1-piperazinyl)methyl]phenyl]-3-phenylmethoxy-5-quinolinyl]-2-oxoethyl]urea IUPAC Name: [2-[4-amino-2-methyl-3-phenylmethoxy-6-[3-(4-phenylpiperazine-1-carbonyl)phenyl]quinolin-5-yl]-2-oxoethyl]urea Traditional Name: [2-[4-amino-3-benzoxy-2-methyl-6-[3-(4-phenylpiperazine-1-carbonyl)phenyl]-5-quinolyl]-2-keto-ethyl]urea Formula: C37H36N6O4 MolecularWeight: 628.71954

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)N4CCN(CC4)C5=CC=CC=C5)C(=O)CNC(=O)N)C(=C1OCC6=CC=CC=C6)N

Isomeric SMILES

CC1=NC2=C(C(=C(C=C2)C3=CC(=CC=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5)C(=O)CNC(=O)N)C(=C1OCC6=CC=CC=C6)N

InChI

InChI=1S/C37H36N6O4/c1-24-35(47-23-25-9-4-2-5-10-25)34(38)33-30(41-24)16-15-29(32(33)31(44)22-40-37(39)46)26-11-8-12-27(21-26)36(45)43-19-17-42(18-20-43)28-13-6-3-7-14-28/h2-16,21H,17-20,22-23H2,1H3,(H2,38,41)(H3,39,40,46)