1-[(4-fluorophenyl)methyl]-5-methylperoxysulfanyl-2-(5-methyl-1H-1,2,4-triazol-3-yl)indole

Systemtic Name: 1-[(4-fluorophenyl)methyl]-5-methylperoxysulfanyl-2-(5-methyl-1H-1,2,4-triazol-3-yl)indole Openeye Name: 1-[(4-fluorophenyl)methyl]-5-methylperoxysulfanyl-2-(5-methyl-1H-1,2,4-triazol-3-yl)indole CAS Name: 1-[(4-fluorophenyl)methyl]-2-(5-methyl-1H-1,2,4-triazol-3-yl)-5-indolesulfenic acid methoxy ester IUPAC Name: 1-[(4-fluorophenyl)methyl]-5-methylperoxysulfanyl-2-(5-methyl-1H-1,2,4-triazol-3-yl)indole Traditional Name: 1-(4-fluorobenzyl)-5-(methylperoxythio)-2-(5-methyl-1H-1,2,4-triazol-3-yl)indole Formula: C19H17FN4O2S MolecularWeight: 384.427283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1)C2=CC3=C(N2CC4=CC=C(C=C4)F)C=CC(=C3)SOOC

Isomeric SMILES

CC1=NC(=NN1)C2=CC3=C(N2CC4=CC=C(C=C4)F)C=CC(=C3)SOOC

InChI

InChI=1S/C19H17FN4O2S/c1-12-21-19(23-22-12)18-10-14-9-16(27-26-25-2)7-8-17(14)24(18)11-13-3-5-15(20)6-4-13/h3-10H,11H2,1-2H3,(H,21,22,23)