N-butan-2-yl-4-hexyl-N-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]benzamide

Systemtic Name: N-butan-2-yl-4-hexyl-N-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]benzamide Openeye Name: 4-hexyl-N-[2-(isoxazol-3-ylamino)-2-oxo-ethyl]-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-4-hexyl-N-[2-(3-isoxazolylamino)-2-oxoethyl]benzamide IUPAC Name: N-butan-2-yl-4-hexyl-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]benzamide Traditional Name: 4-hexyl-N-[2-(isoxazol-3-ylamino)-2-keto-ethyl]-N-sec-butyl-benzamide Formula: C22H31N3O3 MolecularWeight: 385.49984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)N(CC(=O)NC2=NOC=C2)C(C)CC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)N(CC(=O)NC2=NOC=C2)C(C)CC

InChI

InChI=1S/C22H31N3O3/c1-4-6-7-8-9-18-10-12-19(13-11-18)22(27)25(17(3)5-2)16-21(26)23-20-14-15-28-24-20/h10-15,17H,4-9,16H2,1-3H3,(H,23,24,26)