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

Systemtic Name: 3-methyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-methyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-methyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-methyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]phthalazine-1-carboxamide Formula: C24H18N4O2S MolecularWeight: 426.49032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4=NN(C(=O)C5=CC=CC=C54)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4=NN(C(=O)C5=CC=CC=C54)C

InChI

InChI=1S/C24H18N4O2S/c1-14-7-12-19-20(13-14)31-23(26-19)15-8-10-16(11-9-15)25-22(29)21-17-5-3-4-6-18(17)24(30)28(2)27-21/h3-13H,1-2H3,(H,25,29)