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

Systemtic Name: 2-(furan-2-ylcarbonyl)-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-(furan-2-carbonyl)-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-[2-furanyl(oxo)methyl]-N-[2-(methylthio)-1,3-benzothiazol-6-yl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-(furan-2-carbonyl)-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-(2-furoyl)-N-[2-(methylthio)-1,3-benzothiazol-6-yl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C23H19N3O3S2 MolecularWeight: 449.54526

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3CC4=CC=CC=C4CN3C(=O)C5=CC=CO5

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)C3CC4=CC=CC=C4CN3C(=O)C5=CC=CO5

InChI

InChI=1S/C23H19N3O3S2/c1-30-23-25-17-9-8-16(12-20(17)31-23)24-21(27)18-11-14-5-2-3-6-15(14)13-26(18)22(28)19-7-4-10-29-19/h2-10,12,18H,11,13H2,1H3,(H,24,27)