N-[4-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazol-2-yl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-[4-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazol-2-yl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[4-(2,3-dihydrobenzofuran-5-yl)thiazol-2-yl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[4-(2,3-dihydrobenzofuran-5-yl)-2-thiazolyl]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[4-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazol-2-yl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-(4-coumaran-5-ylthiazol-2-yl)-4-keto-phthalazine-1-carboxamide Formula: C27H20N4O3S MolecularWeight: 480.5377

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)C3=CSC(=N3)NC(=O)C4=NN(C(=O)C5=CC=CC=C54)CC6=CC=CC=C6

Isomeric SMILES

C1COC2=C1C=C(C=C2)C3=CSC(=N3)NC(=O)C4=NN(C(=O)C5=CC=CC=C54)CC6=CC=CC=C6

InChI

InChI=1S/C27H20N4O3S/c32-25(29-27-28-22(16-35-27)18-10-11-23-19(14-18)12-13-34-23)24-20-8-4-5-9-21(20)26(33)31(30-24)15-17-6-2-1-3-7-17/h1-11,14,16H,12-13,15H2,(H,28,29,32)