2-[(2-fluoranylphenoxy)methyl]-N-[4-(3-methylbutanoylamino)cyclohexyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[(2-fluoranylphenoxy)methyl]-N-[4-(3-methylbutanoylamino)cyclohexyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[(2-fluorophenoxy)methyl]-N-[4-(3-methylbutanoylamino)cyclohexyl]thiazole-4-carboxamide CAS Name: 2-[(2-fluorophenoxy)methyl]-N-[4-[(3-methyl-1-oxobutyl)amino]cyclohexyl]-4-thiazolecarboxamide IUPAC Name: 2-[(2-fluorophenoxy)methyl]-N-[4-(3-methylbutanoylamino)cyclohexyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[(2-fluorophenoxy)methyl]-N-[4-(isovalerylamino)cyclohexyl]thiazole-4-carboxamide Formula: C22H28FN3O3S MolecularWeight: 433.539423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1CCC(CC1)NC(=O)C2=CSC(=N2)COC3=CC=CC=C3F

Isomeric SMILES

CC(C)CC(=O)NC1CCC(CC1)NC(=O)C2=CSC(=N2)COC3=CC=CC=C3F

InChI

InChI=1S/C22H28FN3O3S/c1-14(2)11-20(27)24-15-7-9-16(10-8-15)25-22(28)18-13-30-21(26-18)12-29-19-6-4-3-5-17(19)23/h3-6,13-16H,7-12H2,1-2H3,(H,24,27)(H,25,28)