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

Systemtic Name: 2-methyl-N'-[1-oxidanylidene-3-(4-phenylmethoxyphenyl)-1-(pyridin-3-ylamino)propan-2-yl]pentanediamide Openeye Name: N'-[1-[(4-benzyloxyphenyl)methyl]-2-oxo-2-(3-pyridylamino)ethyl]-2-methyl-pentanediamide CAS Name: 2-methyl-N'-[1-oxo-3-(4-phenylmethoxyphenyl)-1-(3-pyridinylamino)propan-2-yl]pentanediamide IUPAC Name: 2-methyl-N'-[1-oxo-3-(4-phenylmethoxyphenyl)-1-(pyridin-3-ylamino)propan-2-yl]pentanediamide Traditional Name: N'-[1-(4-benzoxybenzyl)-2-keto-2-(3-pyridylamino)ethyl]-2-methyl-glutaramide Formula: C27H30N4O4 MolecularWeight: 474.5515

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)NC(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)NC3=CN=CC=C3)C(=O)N

Isomeric SMILES

CC(CCC(=O)NC(CC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)NC3=CN=CC=C3)C(=O)N

InChI

InChI=1S/C27H30N4O4/c1-19(26(28)33)9-14-25(32)31-24(27(34)30-22-8-5-15-29-17-22)16-20-10-12-23(13-11-20)35-18-21-6-3-2-4-7-21/h2-8,10-13,15,17,19,24H,9,14,16,18H2,1H3,(H2,28,33)(H,30,34)(H,31,32)