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

Systemtic Name: N-[4-(tert-butylcarbamoylamino)cyclohexyl]-2-[(2-fluoranylphenoxy)methyl]-1,3-thiazole-4-carboxamide Openeye Name: N-[4-(tert-butylcarbamoylamino)cyclohexyl]-2-[(2-fluorophenoxy)methyl]thiazole-4-carboxamide CAS Name: N-[4-[[(tert-butylamino)-oxomethyl]amino]cyclohexyl]-2-[(2-fluorophenoxy)methyl]-4-thiazolecarboxamide IUPAC Name: N-[4-(tert-butylcarbamoylamino)cyclohexyl]-2-[(2-fluorophenoxy)methyl]-1,3-thiazole-4-carboxamide Traditional Name: N-[4-(tert-butylcarbamoylamino)cyclohexyl]-2-[(2-fluorophenoxy)methyl]thiazole-4-carboxamide Formula: C22H29FN4O3S MolecularWeight: 448.554063

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29FN4O3S/c1-22(2,3)27-21(29)25-15-10-8-14(9-11-15)24-20(28)17-13-31-19(26-17)12-30-18-7-5-4-6-16(18)23/h4-7,13-15H,8-12H2,1-3H3,(H,24,28)(H2,25,27,29)