2-[[5-(2-fluorophenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[5-(2-fluorophenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[[5-(2-fluorophenyl)-4-isopropyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2-[[[5-(2-fluorophenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[5-(2-fluorophenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[[[5-(2-fluorophenyl)-4-isopropyl-1,2,4-triazol-3-yl]thio]methyl]-1H-quinazolin-4-one Formula: C20H18FN5OS MolecularWeight: 395.453223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NN=C1SCC2=NC(=O)C3=CC=CC=C3N2)C4=CC=CC=C4F

Isomeric SMILES

CC(C)N1C(=NN=C1SCC2=NC(=O)C3=CC=CC=C3N2)C4=CC=CC=C4F

InChI

InChI=1S/C20H18FN5OS/c1-12(2)26-18(13-7-3-5-9-15(13)21)24-25-20(26)28-11-17-22-16-10-6-4-8-14(16)19(27)23-17/h3-10,12H,11H2,1-2H3,(H,22,23,27)