2-[[5-[(4-chloranylphenoxy)methyl]-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-fluorophenyl)ethanamide

Systemtic Name: 2-[[5-[(4-chloranylphenoxy)methyl]-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-fluorophenyl)ethanamide Openeye Name: 2-[[5-[(4-chlorophenoxy)methyl]-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-fluorophenyl)acetamide CAS Name: 2-[[5-[(4-chlorophenoxy)methyl]-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-(3-fluorophenyl)acetamide IUPAC Name: 2-[[5-[(4-chlorophenoxy)methyl]-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-fluorophenyl)acetamide Traditional Name: 2-[[5-[(4-chlorophenoxy)methyl]-4-p-phenetyl-1,2,4-triazol-3-yl]thio]-N-(3-fluorophenyl)acetamide Formula: C25H22ClFN4O3S MolecularWeight: 512.983583

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC(=CC=C3)F)COC4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC(=CC=C3)F)COC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H22ClFN4O3S/c1-2-33-21-12-8-20(9-13-21)31-23(15-34-22-10-6-17(26)7-11-22)29-30-25(31)35-16-24(32)28-19-5-3-4-18(27)14-19/h3-14H,2,15-16H2,1H3,(H,28,32)