N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-(4-chlorophenyl)-1-keto-isoquinoline-4-carboxamide Formula: C23H14ClN3O2S MolecularWeight: 431.89416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN(C2=O)C3=CC=C(C=C3)Cl)C(=O)NC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN(C2=O)C3=CC=C(C=C3)Cl)C(=O)NC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H14ClN3O2S/c24-14-9-11-15(12-10-14)27-13-18(16-5-1-2-6-17(16)22(27)29)21(28)26-23-25-19-7-3-4-8-20(19)30-23/h1-13H,(H,25,26,28)