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

Systemtic Name: N-butan-2-yl-N-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]-4-pentyl-benzamide Openeye Name: N-[2-(isoxazol-3-ylamino)-2-oxo-ethyl]-4-pentyl-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-N-[2-(3-isoxazolylamino)-2-oxoethyl]-4-pentylbenzamide IUPAC Name: N-butan-2-yl-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-4-pentylbenzamide Traditional Name: 4-amyl-N-[2-(isoxazol-3-ylamino)-2-keto-ethyl]-N-sec-butyl-benzamide Formula: C21H29N3O3 MolecularWeight: 371.47326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3O3/c1-4-6-7-8-17-9-11-18(12-10-17)21(26)24(16(3)5-2)15-20(25)22-19-13-14-27-23-19/h9-14,16H,4-8,15H2,1-3H3,(H,22,23,25)