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

Systemtic Name: N-(3-methylbutyl)-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]-4-pentyl-benzamide Openeye Name: N-isopentyl-N-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]-4-pentyl-benzamide CAS Name: N-(3-methylbutyl)-N-[2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl]-4-pentylbenzamide IUPAC Name: N-(3-methylbutyl)-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-4-pentylbenzamide Traditional Name: 4-amyl-N-isoamyl-N-[2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl]benzamide Formula: C23H33N3O3 MolecularWeight: 399.52642

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C23H33N3O3/c1-5-6-7-8-19-9-11-20(12-10-19)23(28)26(14-13-17(2)3)16-22(27)24-21-15-18(4)29-25-21/h9-12,15,17H,5-8,13-14,16H2,1-4H3,(H,24,25,27)