N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide

Systemtic Name: N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: N-[4-(3,4-dimethylphenyl)thiazol-2-yl]-3-isopropyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[4-(3,4-dimethylphenyl)-2-thiazolyl]-4-oxo-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-4-oxo-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: N-[4-(3,4-dimethylphenyl)thiazol-2-yl]-3-isopropyl-4-keto-phthalazine-1-carboxamide Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C(C)C)C

InChI

InChI=1S/C23H22N4O2S/c1-13(2)27-22(29)18-8-6-5-7-17(18)20(26-27)21(28)25-23-24-19(12-30-23)16-10-9-14(3)15(4)11-16/h5-13H,1-4H3,(H,24,25,28)