N-[2-methyl-5-[(3-morpholin-4-ylphenyl)carbonylamino]phenyl]-3-[(4-methylpiperazin-1-yl)methyl]benzamide

Systemtic Name: N-[2-methyl-5-[(3-morpholin-4-ylphenyl)carbonylamino]phenyl]-3-[(4-methylpiperazin-1-yl)methyl]benzamide Openeye Name: N-[2-methyl-5-[(3-morpholinobenzoyl)amino]phenyl]-3-[(4-methylpiperazin-1-yl)methyl]benzamide CAS Name: N-[2-methyl-5-[[[3-(4-morpholinyl)phenyl]-oxomethyl]amino]phenyl]-3-[(4-methyl-1-piperazinyl)methyl]benzamide IUPAC Name: N-[2-methyl-5-[(3-morpholin-4-ylbenzoyl)amino]phenyl]-3-[(4-methylpiperazin-1-yl)methyl]benzamide Traditional Name: N-[2-methyl-5-[(3-morpholinobenzoyl)amino]phenyl]-3-[(4-methylpiperazino)methyl]benzamide Formula: C31H37N5O3 MolecularWeight: 527.65718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)N3CCOCC3)NC(=O)C4=CC(=CC=C4)CN5CCN(CC5)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)N3CCOCC3)NC(=O)C4=CC(=CC=C4)CN5CCN(CC5)C

InChI

InChI=1S/C31H37N5O3/c1-23-9-10-27(32-30(37)26-7-4-8-28(20-26)36-15-17-39-18-16-36)21-29(23)33-31(38)25-6-3-5-24(19-25)22-35-13-11-34(2)12-14-35/h3-10,19-21H,11-18,22H2,1-2H3,(H,32,37)(H,33,38)