4-(3,4-dimethylphenyl)-2-[(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)methyl]phthalazin-1-one

Systemtic Name: 4-(3,4-dimethylphenyl)-2-[(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)methyl]phthalazin-1-one Openeye Name: 4-(3,4-dimethylphenyl)-2-[(2-thioxo-3H-1,3,4-oxadiazol-5-yl)methyl]phthalazin-1-one CAS Name: 4-(3,4-dimethylphenyl)-2-[(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)methyl]-1-phthalazinone IUPAC Name: 4-(3,4-dimethylphenyl)-2-[(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)methyl]phthalazin-1-one Traditional Name: 4-(3,4-dimethylphenyl)-2-[(2-thioxo-3H-1,3,4-oxadiazol-5-yl)methyl]phthalazin-1-one Formula: C19H16N4O2S MolecularWeight: 364.42094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CC4=NNC(=S)O4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CC4=NNC(=S)O4)C

InChI

InChI=1S/C19H16N4O2S/c1-11-7-8-13(9-12(11)2)17-14-5-3-4-6-15(14)18(24)23(22-17)10-16-20-21-19(26)25-16/h3-9H,10H2,1-2H3,(H,21,26)