3-[1-(1,3-benzothiazol-6-ylamino)isoquinolin-5-yl]phenol

Systemtic Name: 3-[1-(1,3-benzothiazol-6-ylamino)isoquinolin-5-yl]phenol Openeye Name: 3-[1-(1,3-benzothiazol-6-ylamino)-5-isoquinolyl]phenol CAS Name: 3-[1-(1,3-benzothiazol-6-ylamino)-5-isoquinolinyl]phenol IUPAC Name: 3-[1-(1,3-benzothiazol-6-ylamino)isoquinolin-5-yl]phenol Traditional Name: 3-[1-(1,3-benzothiazol-6-ylamino)-5-isoquinolyl]phenol Formula: C22H15N3OS MolecularWeight: 369.439

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)O)C2=CC=CC3=C2C=CN=C3NC4=CC5=C(C=C4)N=CS5

Isomeric SMILES

C1=CC(=CC(=C1)O)C2=CC=CC3=C2C=CN=C3NC4=CC5=C(C=C4)N=CS5

InChI

InChI=1S/C22H15N3OS/c26-16-4-1-3-14(11-16)17-5-2-6-19-18(17)9-10-23-22(19)25-15-7-8-20-21(12-15)27-13-24-20/h1-13,26H,(H,23,25)