N-(6-fluoranyl-1,3-benzothiazol-2-yl)-2-(furan-2-ylcarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-(6-fluoranyl-1,3-benzothiazol-2-yl)-2-(furan-2-ylcarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(furan-2-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-2-[2-furanyl(oxo)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(furan-2-carbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-2-(2-furoyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C22H16FN3O3S MolecularWeight: 421.444143

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)C(=O)C3=CC=CO3)C(=O)NC4=NC5=C(S4)C=C(C=C5)F

Isomeric SMILES

C1C(N(CC2=CC=CC=C21)C(=O)C3=CC=CO3)C(=O)NC4=NC5=C(S4)C=C(C=C5)F

InChI

InChI=1S/C22H16FN3O3S/c23-15-7-8-16-19(11-15)30-22(24-16)25-20(27)17-10-13-4-1-2-5-14(13)12-26(17)21(28)18-6-3-9-29-18/h1-9,11,17H,10,12H2,(H,24,25,27)