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

Systemtic Name: N-[4-(4-methyl-1,3-thiazol-2-yl)-1,2,5-oxadiazol-3-yl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[4-(4-methylthiazol-2-yl)-1,2,5-oxadiazol-3-yl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[4-(4-methyl-2-thiazolyl)-1,2,5-oxadiazol-3-yl]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[4-(4-methyl-1,3-thiazol-2-yl)-1,2,5-oxadiazol-3-yl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-[4-(4-methylthiazol-2-yl)furazan-3-yl]phthalazine-1-carboxamide Formula: C22H16N6O3S MolecularWeight: 444.46584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C2=NON=C2NC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

CC1=CSC(=N1)C2=NON=C2NC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C22H16N6O3S/c1-13-12-32-21(23-13)18-19(27-31-26-18)24-20(29)17-15-9-5-6-10-16(15)22(30)28(25-17)11-14-7-3-2-4-8-14/h2-10,12H,11H2,1H3,(H,24,27,29)