N-(1,3-benzothiazol-2-yl)-2-(5-methoxy-1-oxidanylidene-isoquinolin-2-yl)ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-(5-methoxy-1-oxidanylidene-isoquinolin-2-yl)ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-(5-methoxy-1-oxo-2-isoquinolyl)acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-(5-methoxy-1-oxo-2-isoquinolinyl)acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-(5-methoxy-1-oxoisoquinolin-2-yl)acetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-(1-keto-5-methoxy-2-isoquinolyl)acetamide Formula: C19H15N3O3S MolecularWeight: 365.4057

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C=CN(C2=O)CC(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=CC2=C1C=CN(C2=O)CC(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H15N3O3S/c1-25-15-7-4-5-13-12(15)9-10-22(18(13)24)11-17(23)21-19-20-14-6-2-3-8-16(14)26-19/h2-10H,11H2,1H3,(H,20,21,23)