7-(4-fluorophenyl)-1-methyl-2,7-dihydropyrazolo[3,4-d][1,3]thiazepin-4-one

Systemtic Name: 7-(4-fluorophenyl)-1-methyl-2,7-dihydropyrazolo[3,4-d][1,3]thiazepin-4-one Openeye Name: 7-(4-fluorophenyl)-1-methyl-2,7-dihydropyrazolo[3,4-d][1,3]thiazepin-4-one CAS Name: 7-(4-fluorophenyl)-1-methyl-2,7-dihydropyrazolo[3,4-d][1,3]thiazepin-4-one IUPAC Name: 7-(4-fluorophenyl)-1-methyl-2,7-dihydropyrazolo[3,4-d][1,3]thiazepin-4-one Traditional Name: 7-(4-fluorophenyl)-1-methyl-2,7-dihydropyrazolo[3,4-d][1,3]thiazepin-4-one Formula: C13H12FN3OS MolecularWeight: 277.317283

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NC(SCC(=O)C2=CN1)C3=CC=C(C=C3)F

Isomeric SMILES

CN1C2=NC(SCC(=O)C2=CN1)C3=CC=C(C=C3)F

InChI

InChI=1S/C13H12FN3OS/c1-17-12-10(6-15-17)11(18)7-19-13(16-12)8-2-4-9(14)5-3-8/h2-6,13,15H,7H2,1H3