N-butan-2-yl-2-[[butan-2-yl-[(E)-3-phenylprop-2-enoyl]amino]methyl]-1,3-oxazole-4-carboxamide

Systemtic Name: N-butan-2-yl-2-[[butan-2-yl-[(E)-3-phenylprop-2-enoyl]amino]methyl]-1,3-oxazole-4-carboxamide Openeye Name: 2-[[[(E)-3-phenylprop-2-enoyl]-sec-butyl-amino]methyl]-N-sec-butyl-oxazole-4-carboxamide CAS Name: N-butan-2-yl-2-[[butan-2-yl-[(E)-1-oxo-3-phenylprop-2-enyl]amino]methyl]-4-oxazolecarboxamide IUPAC Name: N-butan-2-yl-2-[[butan-2-yl-[(E)-3-phenylprop-2-enoyl]amino]methyl]-1,3-oxazole-4-carboxamide Traditional Name: 2-[[[(E)-3-phenylacryloyl]-sec-butyl-amino]methyl]-N-sec-butyl-oxazole-4-carboxamide Formula: C22H29N3O3 MolecularWeight: 383.48396

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=COC(=N1)CN(C(C)CC)C(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CCC(C)NC(=O)C1=COC(=N1)CN(C(C)CC)C(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C22H29N3O3/c1-5-16(3)23-22(27)19-15-28-20(24-19)14-25(17(4)6-2)21(26)13-12-18-10-8-7-9-11-18/h7-13,15-17H,5-6,14H2,1-4H3,(H,23,27)/b13-12+