N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]-N-(2-methylpropyl)-4-pentyl-benzamide

Systemtic Name: N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]-N-(2-methylpropyl)-4-pentyl-benzamide Openeye Name: N-isobutyl-N-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]-4-pentyl-benzamide CAS Name: N-[2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl]-N-(2-methylpropyl)-4-pentylbenzamide IUPAC Name: N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-N-(2-methylpropyl)-4-pentylbenzamide Traditional Name: 4-amyl-N-isobutyl-N-[2-keto-2-[(5-methylisoxazol-3-yl)amino]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(CC(C)C)CC(=O)NC2=NOC(=C2)C

Isomeric SMILES

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

InChI

InChI=1S/C22H31N3O3/c1-5-6-7-8-18-9-11-19(12-10-18)22(27)25(14-16(2)3)15-21(26)23-20-13-17(4)28-24-20/h9-13,16H,5-8,14-15H2,1-4H3,(H,23,24,26)