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

Systemtic Name: N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: 3-isopropyl-4-oxo-N-[4-(p-tolyl)thiazol-2-yl]phthalazine-1-carboxamide CAS Name: N-[4-(4-methylphenyl)-2-thiazolyl]-4-oxo-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-4-oxo-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: 3-isopropyl-4-keto-N-[4-(p-tolyl)thiazol-2-yl]phthalazine-1-carboxamide Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20N4O2S/c1-13(2)26-21(28)17-7-5-4-6-16(17)19(25-26)20(27)24-22-23-18(12-29-22)15-10-8-14(3)9-11-15/h4-13H,1-3H3,(H,23,24,27)