3-[[2,6-bis(fluoranyl)-4-methyl-phenyl]methoxy]-5-[5-(4-oxidanylpiperidin-1-yl)pentylcarbamoylamino]-1,2-thiazole-4-carboxamide

Systemtic Name: 3-[[2,6-bis(fluoranyl)-4-methyl-phenyl]methoxy]-5-[5-(4-oxidanylpiperidin-1-yl)pentylcarbamoylamino]-1,2-thiazole-4-carboxamide Openeye Name: 3-[(2,6-difluoro-4-methyl-phenyl)methoxy]-5-[5-(4-hydroxy-1-piperidyl)pentylcarbamoylamino]isothiazole-4-carboxamide CAS Name: 3-[(2,6-difluoro-4-methylphenyl)methoxy]-5-[[[5-(4-hydroxy-1-piperidinyl)pentylamino]-oxomethyl]amino]-4-isothiazolecarboxamide IUPAC Name: 3-[(2,6-difluoro-4-methylphenyl)methoxy]-5-[5-(4-hydroxypiperidin-1-yl)pentylcarbamoylamino]-1,2-thiazole-4-carboxamide Traditional Name: 3-(2,6-difluoro-4-methyl-benzyl)oxy-5-[5-(4-hydroxypiperidino)pentylcarbamoylamino]isothiazole-4-carboxamide Formula: C23H31F2N5O4S MolecularWeight: 511.585146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)F)COC2=NSC(=C2C(=O)N)NC(=O)NCCCCCN3CCC(CC3)O)F

Isomeric SMILES

CC1=CC(=C(C(=C1)F)COC2=NSC(=C2C(=O)N)NC(=O)NCCCCCN3CCC(CC3)O)F

InChI

InChI=1S/C23H31F2N5O4S/c1-14-11-17(24)16(18(25)12-14)13-34-21-19(20(26)32)22(35-29-21)28-23(33)27-7-3-2-4-8-30-9-5-15(31)6-10-30/h11-12,15,31H,2-10,13H2,1H3,(H2,26,32)(H2,27,28,33)