2-[(5-chloranyl-1,2,3-thiadiazol-4-yl)methyl]-4-(2,5-dimethylphenyl)phthalazin-1-one

Systemtic Name: 2-[(5-chloranyl-1,2,3-thiadiazol-4-yl)methyl]-4-(2,5-dimethylphenyl)phthalazin-1-one Openeye Name: 2-[(5-chlorothiadiazol-4-yl)methyl]-4-(2,5-dimethylphenyl)phthalazin-1-one CAS Name: 2-[(5-chloro-4-thiadiazolyl)methyl]-4-(2,5-dimethylphenyl)-1-phthalazinone IUPAC Name: 2-[(5-chlorothiadiazol-4-yl)methyl]-4-(2,5-dimethylphenyl)phthalazin-1-one Traditional Name: 2-[(5-chlorothiadiazol-4-yl)methyl]-4-(2,5-dimethylphenyl)phthalazin-1-one Formula: C19H15ClN4OS MolecularWeight: 382.8666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=NN(C(=O)C3=CC=CC=C32)CC4=C(SN=N4)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=NN(C(=O)C3=CC=CC=C32)CC4=C(SN=N4)Cl

InChI

InChI=1S/C19H15ClN4OS/c1-11-7-8-12(2)15(9-11)17-13-5-3-4-6-14(13)19(25)24(22-17)10-16-18(20)26-23-21-16/h3-9H,10H2,1-2H3