(8E)-8-(3-azanyl-2H-isoquinolin-1-ylidene)-6H-pyrrolo[2,3-g][1,3]benzothiazol-7-one

Systemtic Name: (8E)-8-(3-azanyl-2H-isoquinolin-1-ylidene)-6H-pyrrolo[2,3-g][1,3]benzothiazol-7-one Openeye Name: (8E)-8-(3-amino-2H-isoquinolin-1-ylidene)-6H-pyrrolo[2,3-g][1,3]benzothiazol-7-one CAS Name: (8E)-8-(3-amino-2H-isoquinolin-1-ylidene)-6H-pyrrolo[2,3-g][1,3]benzothiazol-7-one IUPAC Name: (8E)-8-(3-amino-2H-isoquinolin-1-ylidene)-6H-pyrrolo[2,3-g][1,3]benzothiazol-7-one Traditional Name: (8E)-8-(3-amino-2H-isoquinolin-1-ylidene)-6H-pyrrolo[2,3-g][1,3]benzothiazol-7-one Formula: C18H12N4OS MolecularWeight: 332.37908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(NC2=C3C4=C(C=CC5=C4SC=N5)NC3=O)N

Isomeric SMILES

C1=CC=C\2C(=C1)C=C(N/C2=C/3\C4=C(C=CC5=C4SC=N5)NC3=O)N

InChI

InChI=1S/C18H12N4OS/c19-13-7-9-3-1-2-4-10(9)16(22-13)15-14-11(21-18(15)23)5-6-12-17(14)24-8-20-12/h1-8,22H,19H2,(H,21,23)/b16-15+