N-[4-[(butanoylamino)-ethyl-amino]-3-oxidanyl-1-phenyl-butan-2-yl]-2-(3-methyl-1,2-oxazol-5-yl)ethanamide

Systemtic Name: N-[4-[(butanoylamino)-ethyl-amino]-3-oxidanyl-1-phenyl-butan-2-yl]-2-(3-methyl-1,2-oxazol-5-yl)ethanamide Openeye Name: N-[1-benzyl-3-[(butanoylamino)-ethyl-amino]-2-hydroxy-propyl]-2-(3-methylisoxazol-5-yl)acetamide CAS Name: N-[4-[ethyl-(1-oxobutylamino)amino]-3-hydroxy-1-phenylbutan-2-yl]-2-(3-methyl-5-isoxazolyl)acetamide IUPAC Name: N-[4-[(butanoylamino)-ethylamino]-3-hydroxy-1-phenylbutan-2-yl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide Traditional Name: N-[1-benzyl-3-[butyramido(ethyl)amino]-2-hydroxy-propyl]-2-(3-methylisoxazol-5-yl)acetamide Formula: C22H32N4O4 MolecularWeight: 416.51388

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NN(CC)CC(C(CC1=CC=CC=C1)NC(=O)CC2=CC(=NO2)C)O

Isomeric SMILES

CCCC(=O)NN(CC)CC(C(CC1=CC=CC=C1)NC(=O)CC2=CC(=NO2)C)O

InChI

InChI=1S/C22H32N4O4/c1-4-9-21(28)24-26(5-2)15-20(27)19(13-17-10-7-6-8-11-17)23-22(29)14-18-12-16(3)25-30-18/h6-8,10-12,19-20,27H,4-5,9,13-15H2,1-3H3,(H,23,29)(H,24,28)