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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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