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

Systemtic Name: (E)-2-[(2-methylpropylamino)-propanoyl-amino]-N-(oxan-2-yloxy)-5-phenyl-pent-4-enamide Openeye Name: (E)-2-[(isobutylamino)-propanoyl-amino]-5-phenyl-N-tetrahydropyran-2-yloxy-pent-4-enamide CAS Name: (E)-2-[(2-methylpropylamino)-(1-oxopropyl)amino]-N-(2-oxanyloxy)-5-phenyl-4-pentenamide IUPAC Name: (E)-2-[(2-methylpropylamino)-propanoylamino]-N-(oxan-2-yloxy)-5-phenylpent-4-enamide Traditional Name: (E)-2-[(isobutylamino)-propionyl-amino]-5-phenyl-N-tetrahydropyran-2-yloxy-pent-4-enamide Formula: C23H35N3O4 MolecularWeight: 417.5417

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H35N3O4/c1-4-21(27)26(24-17-18(2)3)20(14-10-13-19-11-6-5-7-12-19)23(28)25-30-22-15-8-9-16-29-22/h5-7,10-13,18,20,22,24H,4,8-9,14-17H2,1-3H3,(H,25,28)/b13-10+