N-(1,3-benzothiazol-2-yl)-2-[2-(1-oxidanylideneisoquinolin-2-yl)ethanoylamino]ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-[2-(1-oxidanylideneisoquinolin-2-yl)ethanoylamino]ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-[[2-(1-oxo-2-isoquinolyl)acetyl]amino]acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[[1-oxo-2-(1-oxo-2-isoquinolinyl)ethyl]amino]acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-[[2-(1-oxoisoquinolin-2-yl)acetyl]amino]acetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[[2-(1-keto-2-isoquinolyl)acetyl]amino]acetamide Formula: C20H16N4O3S MolecularWeight: 392.43104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN(C2=O)CC(=O)NCC(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C2C(=C1)C=CN(C2=O)CC(=O)NCC(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H16N4O3S/c25-17(23-20-22-15-7-3-4-8-16(15)28-20)11-21-18(26)12-24-10-9-13-5-1-2-6-14(13)19(24)27/h1-10H,11-12H2,(H,21,26)(H,22,23,25)