2-(1,3-benzothiazol-2-ylmethyl)isoquinolin-1-one

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethyl)isoquinolin-1-one Openeye Name: 2-(1,3-benzothiazol-2-ylmethyl)isoquinolin-1-one CAS Name: 2-(1,3-benzothiazol-2-ylmethyl)-1-isoquinolinone IUPAC Name: 2-(1,3-benzothiazol-2-ylmethyl)isoquinolin-1-one Traditional Name: 2-(1,3-benzothiazol-2-ylmethyl)isocarbostyril Formula: C17H12N2OS MolecularWeight: 292.35498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN(C2=O)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C2C(=C1)C=CN(C2=O)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H12N2OS/c20-17-13-6-2-1-5-12(13)9-10-19(17)11-16-18-14-7-3-4-8-15(14)21-16/h1-10H,11H2