N-[5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-7-oxidanylidene-5,6-dihydro-4H-1,3-benzothiazol-2-yl]furan-3-carboxamide

Systemtic Name: N-[5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-7-oxidanylidene-5,6-dihydro-4H-1,3-benzothiazol-2-yl]furan-3-carboxamide Openeye Name: N-[5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-7-oxo-5,6-dihydro-4H-1,3-benzothiazol-2-yl]furan-3-carboxamide CAS Name: N-[5-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-7-oxo-5,6-dihydro-4H-1,3-benzothiazol-2-yl]-3-furancarboxamide IUPAC Name: N-[5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-7-oxo-5,6-dihydro-4H-1,3-benzothiazol-2-yl]furan-3-carboxamide Traditional Name: N-[5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-7-keto-5,6-dihydro-4H-1,3-benzothiazol-2-yl]-3-furamide Formula: C22H19N3O4S MolecularWeight: 421.46896

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3CC4=C(C(=O)C3)SC(=N4)NC(=O)C5=COC=C5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3CC4=C(C(=O)C3)SC(=N4)NC(=O)C5=COC=C5

InChI

InChI=1S/C22H19N3O4S/c26-18-10-16(21(28)25-7-5-13-3-1-2-4-14(13)11-25)9-17-19(18)30-22(23-17)24-20(27)15-6-8-29-12-15/h1-4,6,8,12,16H,5,7,9-11H2,(H,23,24,27)