(E)-2-[3-methylbutanoyl-(2-methylpropylamino)amino]-N-(oxan-2-yloxy)-5-phenyl-pent-4-enamide

Systemtic Name: (E)-2-[3-methylbutanoyl-(2-methylpropylamino)amino]-N-(oxan-2-yloxy)-5-phenyl-pent-4-enamide Openeye Name: (E)-2-[(isobutylamino)-(3-methylbutanoyl)amino]-5-phenyl-N-tetrahydropyran-2-yloxy-pent-4-enamide CAS Name: (E)-2-[(3-methyl-1-oxobutyl)-(2-methylpropylamino)amino]-N-(2-oxanyloxy)-5-phenyl-4-pentenamide IUPAC Name: (E)-2-[3-methylbutanoyl-(2-methylpropylamino)amino]-N-(oxan-2-yloxy)-5-phenylpent-4-enamide Traditional Name: (E)-2-[(isobutylamino)-isovaleryl-amino]-5-phenyl-N-tetrahydropyran-2-yloxy-pent-4-enamide Formula: C25H39N3O4 MolecularWeight: 445.59486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N(C(CC=CC1=CC=CC=C1)C(=O)NOC2CCCCO2)NCC(C)C

Isomeric SMILES

CC(C)CC(=O)N(C(C/C=C/C1=CC=CC=C1)C(=O)NOC2CCCCO2)NCC(C)C

InChI

InChI=1S/C25H39N3O4/c1-19(2)17-23(29)28(26-18-20(3)4)22(14-10-13-21-11-6-5-7-12-21)25(30)27-32-24-15-8-9-16-31-24/h5-7,10-13,19-20,22,24,26H,8-9,14-18H2,1-4H3,(H,27,30)/b13-10+