N-[4,5-bis(4-methylphenyl)-1,3-thiazol-2-yl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[4,5-bis(4-methylphenyl)-1,3-thiazol-2-yl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[4,5-bis(p-tolyl)thiazol-2-yl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[4,5-bis(4-methylphenyl)-2-thiazolyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[4,5-bis(4-methylphenyl)-1,3-thiazol-2-yl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[4,5-bis(p-tolyl)thiazol-2-yl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C27H22N4O2S MolecularWeight: 466.55418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C)C5=CC=C(C=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC(=N2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)C)C5=CC=C(C=C5)C

InChI

InChI=1S/C27H22N4O2S/c1-16-8-12-18(13-9-16)22-24(19-14-10-17(2)11-15-19)34-27(28-22)29-25(32)23-20-6-4-5-7-21(20)26(33)31(3)30-23/h4-15H,1-3H3,(H,28,29,32)