N-(5-chloranyl-2-methyl-phenyl)-2-[[5-[[(4-fluorophenyl)amino]methyl]-4-(oxolan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-2-[[5-[[(4-fluorophenyl)amino]methyl]-4-(oxolan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(5-chloro-2-methyl-phenyl)-2-[[5-[(4-fluoroanilino)methyl]-4-(tetrahydrofuran-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(5-chloro-2-methylphenyl)-2-[[5-[(4-fluoroanilino)methyl]-4-(2-oxolanylmethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(5-chloro-2-methylphenyl)-2-[[5-[(4-fluoroanilino)methyl]-4-(oxolan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(5-chloro-2-methyl-phenyl)-2-[[5-[(4-fluoroanilino)methyl]-4-(tetrahydrofurfuryl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C23H25ClFN5O2S MolecularWeight: 489.993303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NN=C(N2CC3CCCO3)CNC4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NN=C(N2CC3CCCO3)CNC4=CC=C(C=C4)F

InChI

InChI=1S/C23H25ClFN5O2S/c1-15-4-5-16(24)11-20(15)27-22(31)14-33-23-29-28-21(30(23)13-19-3-2-10-32-19)12-26-18-8-6-17(25)7-9-18/h4-9,11,19,26H,2-3,10,12-14H2,1H3,(H,27,31)