2-methyl-N'-[1-[3-(4-methylpiperazin-1-yl)propylamino]-1-oxidanylidene-3-(4-phenylmethoxyphenyl)propan-2-yl]pentanediamide

Systemtic Name: 2-methyl-N'-[1-[3-(4-methylpiperazin-1-yl)propylamino]-1-oxidanylidene-3-(4-phenylmethoxyphenyl)propan-2-yl]pentanediamide Openeye Name: N'-[1-[(4-benzyloxyphenyl)methyl]-2-[3-(4-methylpiperazin-1-yl)propylamino]-2-oxo-ethyl]-2-methyl-pentanediamide CAS Name: 2-methyl-N'-[1-[3-(4-methyl-1-piperazinyl)propylamino]-1-oxo-3-(4-phenylmethoxyphenyl)propan-2-yl]pentanediamide IUPAC Name: 2-methyl-N'-[1-[3-(4-methylpiperazin-1-yl)propylamino]-1-oxo-3-(4-phenylmethoxyphenyl)propan-2-yl]pentanediamide Traditional Name: N'-[1-(4-benzoxybenzyl)-2-keto-2-[3-(4-methylpiperazino)propylamino]ethyl]-2-methyl-glutaramide Formula: C30H43N5O4 MolecularWeight: 537.69352

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)NC(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)NCCCN3CCN(CC3)C)C(=O)N

Isomeric SMILES

CC(CCC(=O)NC(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)NCCCN3CCN(CC3)C)C(=O)N

InChI

InChI=1S/C30H43N5O4/c1-23(29(31)37)9-14-28(36)33-27(30(38)32-15-6-16-35-19-17-34(2)18-20-35)21-24-10-12-26(13-11-24)39-22-25-7-4-3-5-8-25/h3-5,7-8,10-13,23,27H,6,9,14-22H2,1-2H3,(H2,31,37)(H,32,38)(H,33,36)