2-(1,3-benzothiazol-2-yl)-4-(3,4-dimethylphenyl)phthalazin-1-one

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-4-(3,4-dimethylphenyl)phthalazin-1-one Openeye Name: 2-(1,3-benzothiazol-2-yl)-4-(3,4-dimethylphenyl)phthalazin-1-one CAS Name: 2-(1,3-benzothiazol-2-yl)-4-(3,4-dimethylphenyl)-1-phthalazinone IUPAC Name: 2-(1,3-benzothiazol-2-yl)-4-(3,4-dimethylphenyl)phthalazin-1-one Traditional Name: 2-(1,3-benzothiazol-2-yl)-4-(3,4-dimethylphenyl)phthalazin-1-one Formula: C23H17N3OS MolecularWeight: 383.46558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)C4=NC5=CC=CC=C5S4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)C4=NC5=CC=CC=C5S4)C

InChI

InChI=1S/C23H17N3OS/c1-14-11-12-16(13-15(14)2)21-17-7-3-4-8-18(17)22(27)26(25-21)23-24-19-9-5-6-10-20(19)28-23/h3-13H,1-2H3