2-methyl-3-[3-methylbutyl-(4-phenylmethoxyphenyl)amino]-2-(3-pyridin-2-ylpropanoylamino)propanamide

Systemtic Name: 2-methyl-3-[3-methylbutyl-(4-phenylmethoxyphenyl)amino]-2-(3-pyridin-2-ylpropanoylamino)propanamide Openeye Name: 3-(4-benzyloxy-N-isopentyl-anilino)-2-methyl-2-[3-(2-pyridyl)propanoylamino]propanamide CAS Name: 2-methyl-3-[N-(3-methylbutyl)-4-phenylmethoxyanilino]-2-[[1-oxo-3-(2-pyridinyl)propyl]amino]propanamide IUPAC Name: 2-methyl-3-[N-(3-methylbutyl)-4-phenylmethoxyanilino]-2-(3-pyridin-2-ylpropanoylamino)propanamide Traditional Name: 3-(4-benzoxy-N-isoamyl-anilino)-2-methyl-2-[3-(2-pyridyl)propanoylamino]propionamide Formula: C30H38N4O3 MolecularWeight: 502.64772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CC(C)(C(=O)N)NC(=O)CCC1=CC=CC=N1)C2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)CCN(CC(C)(C(=O)N)NC(=O)CCC1=CC=CC=N1)C2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C30H38N4O3/c1-23(2)18-20-34(26-13-15-27(16-14-26)37-21-24-9-5-4-6-10-24)22-30(3,29(31)36)33-28(35)17-12-25-11-7-8-19-32-25/h4-11,13-16,19,23H,12,17-18,20-22H2,1-3H3,(H2,31,36)(H,33,35)