3-methyl-4-oxidanylidene-N-phenethyl-N-(4-phenyl-1,3-thiazol-2-yl)phthalazine-1-carboxamide

Systemtic Name: 3-methyl-4-oxidanylidene-N-phenethyl-N-(4-phenyl-1,3-thiazol-2-yl)phthalazine-1-carboxamide Openeye Name: 3-methyl-4-oxo-N-phenethyl-N-(4-phenylthiazol-2-yl)phthalazine-1-carboxamide CAS Name: 3-methyl-4-oxo-N-phenethyl-N-(4-phenyl-2-thiazolyl)-1-phthalazinecarboxamide IUPAC Name: 3-methyl-4-oxo-N-phenethyl-N-(4-phenyl-1,3-thiazol-2-yl)phthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-phenethyl-N-(4-phenylthiazol-2-yl)phthalazine-1-carboxamide Formula: C27H22N4O2S MolecularWeight: 466.55418

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(CCC3=CC=CC=C3)C4=NC(=CS4)C5=CC=CC=C5

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(CCC3=CC=CC=C3)C4=NC(=CS4)C5=CC=CC=C5

InChI

InChI=1S/C27H22N4O2S/c1-30-25(32)22-15-9-8-14-21(22)24(29-30)26(33)31(17-16-19-10-4-2-5-11-19)27-28-23(18-34-27)20-12-6-3-7-13-20/h2-15,18H,16-17H2,1H3