1-[4-(3-bromanyl-6-sulfanylidene-cyclohexa-1,3-dien-1-yl)carbonylpiperazin-1-yl]-2-(4-fluoranyl-1H-indol-3-yl)ethane-1,2-dione

Systemtic Name: 1-[4-(3-bromanyl-6-sulfanylidene-cyclohexa-1,3-dien-1-yl)carbonylpiperazin-1-yl]-2-(4-fluoranyl-1H-indol-3-yl)ethane-1,2-dione Openeye Name: 1-[4-(3-bromo-6-thioxo-cyclohexa-1,3-diene-1-carbonyl)piperazin-1-yl]-2-(4-fluoro-1H-indol-3-yl)ethane-1,2-dione CAS Name: 1-[4-[(3-bromo-6-sulfanylidene-1-cyclohexa-1,3-dienyl)-oxomethyl]-1-piperazinyl]-2-(4-fluoro-1H-indol-3-yl)ethane-1,2-dione IUPAC Name: 1-[4-(3-bromo-6-sulfanylidenecyclohexa-1,3-diene-1-carbonyl)piperazin-1-yl]-2-(4-fluoro-1H-indol-3-yl)ethane-1,2-dione Traditional Name: 1-[4-(3-bromo-6-thioxo-cyclohexa-1,3-diene-1-carbonyl)piperazino]-2-(4-fluoro-1H-indol-3-yl)ethane-1,2-dione Formula: C21H17BrFN3O3S MolecularWeight: 490.345383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=CCC2=S)Br)C(=O)C(=O)C3=CNC4=C3C(=CC=C4)F

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC(=CCC2=S)Br)C(=O)C(=O)C3=CNC4=C3C(=CC=C4)F

InChI

InChI=1S/C21H17BrFN3O3S/c22-12-4-5-17(30)13(10-12)20(28)25-6-8-26(9-7-25)21(29)19(27)14-11-24-16-3-1-2-15(23)18(14)16/h1-4,10-11,24H,5-9H2