2-[2-(1,3-benzothiazol-2-ylsulfonyl)-2-fluoranyl-ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-(1,3-benzothiazol-2-ylsulfonyl)-2-fluoranyl-ethyl]isoindole-1,3-dione Openeye Name: 2-[2-(1,3-benzothiazol-2-ylsulfonyl)-2-fluoro-ethyl]isoindoline-1,3-dione CAS Name: 2-[2-(1,3-benzothiazol-2-ylsulfonyl)-2-fluoroethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(1,3-benzothiazol-2-ylsulfonyl)-2-fluoroethyl]isoindole-1,3-dione Traditional Name: 2-[2-(1,3-benzothiazol-2-ylsulfonyl)-2-fluoro-ethyl]isoindoline-1,3-quinone Formula: C17H11FN2O4S2 MolecularWeight: 390.408643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CC(F)S(=O)(=O)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CC(F)S(=O)(=O)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H11FN2O4S2/c18-14(9-20-15(21)10-5-1-2-6-11(10)16(20)22)26(23,24)17-19-12-7-3-4-8-13(12)25-17/h1-8,14H,9H2