2-propoxy-N-(1,3-thiazol-2-yl)-4-(3,5,5-trimethylhexanoylamino)benzamide

Systemtic Name: 2-propoxy-N-(1,3-thiazol-2-yl)-4-(3,5,5-trimethylhexanoylamino)benzamide Openeye Name: 2-propoxy-N-thiazol-2-yl-4-(3,5,5-trimethylhexanoylamino)benzamide CAS Name: 2-propoxy-N-(2-thiazolyl)-4-[(3,5,5-trimethyl-1-oxohexyl)amino]benzamide IUPAC Name: 2-propoxy-N-(1,3-thiazol-2-yl)-4-(3,5,5-trimethylhexanoylamino)benzamide Traditional Name: 2-propoxy-N-thiazol-2-yl-4-(3,5,5-trimethylhexanoylamino)benzamide Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1)NC(=O)CC(C)CC(C)(C)C)C(=O)NC2=NC=CS2

Isomeric SMILES

CCCOC1=C(C=CC(=C1)NC(=O)CC(C)CC(C)(C)C)C(=O)NC2=NC=CS2

InChI

InChI=1S/C22H31N3O3S/c1-6-10-28-18-13-16(24-19(26)12-15(2)14-22(3,4)5)7-8-17(18)20(27)25-21-23-9-11-29-21/h7-9,11,13,15H,6,10,12,14H2,1-5H3,(H,24,26)(H,23,25,27)