N-(3-methylbutyl)-N-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]-4-pentyl-benzamide

Systemtic Name: N-(3-methylbutyl)-N-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]-4-pentyl-benzamide Openeye Name: N-isopentyl-N-[2-(isoxazol-3-ylamino)-2-oxo-ethyl]-4-pentyl-benzamide CAS Name: N-[2-(3-isoxazolylamino)-2-oxoethyl]-N-(3-methylbutyl)-4-pentylbenzamide IUPAC Name: N-(3-methylbutyl)-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-4-pentylbenzamide Traditional Name: 4-amyl-N-isoamyl-N-[2-(isoxazol-3-ylamino)-2-keto-ethyl]benzamide Formula: C22H31N3O3 MolecularWeight: 385.49984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N(CCC(C)C)CC(=O)NC2=NOC=C2

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N(CCC(C)C)CC(=O)NC2=NOC=C2

InChI

InChI=1S/C22H31N3O3/c1-4-5-6-7-18-8-10-19(11-9-18)22(27)25(14-12-17(2)3)16-21(26)23-20-13-15-28-24-20/h8-11,13,15,17H,4-7,12,14,16H2,1-3H3,(H,23,24,26)