N-(6-methyl-1,3-benzothiazol-2-yl)-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-(6-methyl-1,3-benzothiazol-2-yl)-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-(6-methyl-1,3-benzothiazol-2-yl)-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-(6-methyl-1,3-benzothiazol-2-yl)-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-(6-methyl-1,3-benzothiazol-2-yl)-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: 4-keto-N-(6-methyl-1,3-benzothiazol-2-yl)-3-phenyl-phthalazine-1-carboxamide Formula: C23H16N4O2S MolecularWeight: 412.46374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C23H16N4O2S/c1-14-11-12-18-19(13-14)30-23(24-18)25-21(28)20-16-9-5-6-10-17(16)22(29)27(26-20)15-7-3-2-4-8-15/h2-13H,1H3,(H,24,25,28)