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

Systemtic Name: N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-4-oxo-N-[4-(p-tolyl)thiazol-2-yl]phthalazine-1-carboxamide CAS Name: N-[4-(4-methylphenyl)-2-thiazolyl]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-[4-(p-tolyl)thiazol-2-yl]phthalazine-1-carboxamide Formula: C26H20N4O2S MolecularWeight: 452.5276

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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)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C26H20N4O2S/c1-17-11-13-19(14-12-17)22-16-33-26(27-22)28-24(31)23-20-9-5-6-10-21(20)25(32)30(29-23)15-18-7-3-2-4-8-18/h2-14,16H,15H2,1H3,(H,27,28,31)