N'-(4-bromanyl-2-methyl-phenyl)-N-[2-(4-ethylpiperazin-1-yl)-4-methyl-quinolin-6-yl]butanediamide

Systemtic Name: N'-(4-bromanyl-2-methyl-phenyl)-N-[2-(4-ethylpiperazin-1-yl)-4-methyl-quinolin-6-yl]butanediamide Openeye Name: N'-(4-bromo-2-methyl-phenyl)-N-[2-(4-ethylpiperazin-1-yl)-4-methyl-6-quinolyl]butanediamide CAS Name: N'-(4-bromo-2-methylphenyl)-N-[2-(4-ethyl-1-piperazinyl)-4-methyl-6-quinolinyl]butanediamide IUPAC Name: N'-(4-bromo-2-methylphenyl)-N-[2-(4-ethylpiperazin-1-yl)-4-methylquinolin-6-yl]butanediamide Traditional Name: N'-(4-bromo-2-methyl-phenyl)-N-[2-(4-ethylpiperazino)-4-methyl-6-quinolyl]succinamide Formula: C27H32BrN5O2 MolecularWeight: 538.47928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC3=C(C=C(C=C3)NC(=O)CCC(=O)NC4=C(C=C(C=C4)Br)C)C(=C2)C

Isomeric SMILES

CCN1CCN(CC1)C2=NC3=C(C=C(C=C3)NC(=O)CCC(=O)NC4=C(C=C(C=C4)Br)C)C(=C2)C

InChI

InChI=1S/C27H32BrN5O2/c1-4-32-11-13-33(14-12-32)25-16-18(2)22-17-21(6-8-24(22)30-25)29-26(34)9-10-27(35)31-23-7-5-20(28)15-19(23)3/h5-8,15-17H,4,9-14H2,1-3H3,(H,29,34)(H,31,35)