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

Systemtic Name: 2-methyl-3-[3-methylbutyl-(4-phenylmethoxyphenyl)amino]-2-(3-pyridin-4-ylpropanoylamino)propanamide Openeye Name: 3-(4-benzyloxy-N-isopentyl-anilino)-2-methyl-2-[3-(4-pyridyl)propanoylamino]propanamide CAS Name: 2-methyl-3-[N-(3-methylbutyl)-4-phenylmethoxyanilino]-2-[(1-oxo-3-pyridin-4-ylpropyl)amino]propanamide IUPAC Name: 2-methyl-3-[N-(3-methylbutyl)-4-phenylmethoxyanilino]-2-(3-pyridin-4-ylpropanoylamino)propanamide Traditional Name: 3-(4-benzoxy-N-isoamyl-anilino)-2-methyl-2-[3-(4-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=NC=C1)C2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)CCN(CC(C)(C(=O)N)NC(=O)CCC1=CC=NC=C1)C2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

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