N-(6-bromanyl-1,3-benzothiazol-2-yl)-1-ethyl-6-fluoranyl-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-1-ethyl-6-fluoranyl-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-1-ethyl-6-fluoro-7-[4-(furan-2-carbonyl)piperazin-1-yl]-4-oxo-quinoline-3-carboxamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-1-ethyl-6-fluoro-7-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-4-oxo-3-quinolinecarboxamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-1-ethyl-6-fluoro-7-[4-(furan-2-carbonyl)piperazin-1-yl]-4-oxoquinoline-3-carboxamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-1-ethyl-6-fluoro-7-[4-(2-furoyl)piperazino]-4-keto-quinoline-3-carboxamide Formula: C28H23BrFN5O4S MolecularWeight: 624.480723

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C4=CC=CO4)F)C(=O)NC5=NC6=C(S5)C=C(C=C6)Br

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C4=CC=CO4)F)C(=O)NC5=NC6=C(S5)C=C(C=C6)Br

InChI

InChI=1S/C28H23BrFN5O4S/c1-2-33-15-18(26(37)32-28-31-20-6-5-16(29)12-24(20)40-28)25(36)17-13-19(30)22(14-21(17)33)34-7-9-35(10-8-34)27(38)23-4-3-11-39-23/h3-6,11-15H,2,7-10H2,1H3,(H,31,32,37)