2-[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-[1-(1-methoxypropan-2-yl)-2,5-dimethyl-pyrrol-3-yl]ethanone

Systemtic Name: 2-[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-[1-(1-methoxypropan-2-yl)-2,5-dimethyl-pyrrol-3-yl]ethanone Openeye Name: 2-[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-[1-(2-methoxy-1-methyl-ethyl)-2,5-dimethyl-pyrrol-3-yl]ethanone CAS Name: 2-[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-1-[1-(1-methoxypropan-2-yl)-2,5-dimethyl-3-pyrrolyl]ethanone IUPAC Name: 2-[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-1-[1-(1-methoxypropan-2-yl)-2,5-dimethylpyrrol-3-yl]ethanone Traditional Name: 2-[[5-(4-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-1-[1-(2-methoxy-1-methyl-ethyl)-2,5-dimethyl-pyrrol-3-yl]ethanone Formula: C21H25FN4O2S MolecularWeight: 416.512203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)COC)C)C(=O)CSC2=NN=C(N2C)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=C(N1C(C)COC)C)C(=O)CSC2=NN=C(N2C)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H25FN4O2S/c1-13-10-18(15(3)26(13)14(2)11-28-5)19(27)12-29-21-24-23-20(25(21)4)16-6-8-17(22)9-7-16/h6-10,14H,11-12H2,1-5H3