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

Systemtic Name: N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-methyl-4-oxidanylidene-N-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: N-benzyl-N-[4-(4-bromophenyl)thiazol-2-yl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[4-(4-bromophenyl)-2-thiazolyl]-3-methyl-4-oxo-N-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: N-benzyl-N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-benzyl-N-[4-(4-bromophenyl)thiazol-2-yl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C26H19BrN4O2S MolecularWeight: 531.42366

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(CC3=CC=CC=C3)C4=NC(=CS4)C5=CC=C(C=C5)Br

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(CC3=CC=CC=C3)C4=NC(=CS4)C5=CC=C(C=C5)Br

InChI

InChI=1S/C26H19BrN4O2S/c1-30-24(32)21-10-6-5-9-20(21)23(29-30)25(33)31(15-17-7-3-2-4-8-17)26-28-22(16-34-26)18-11-13-19(27)14-12-18/h2-14,16H,15H2,1H3