4-chloranyl-5-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-pyridazin-3-one

Systemtic Name: 4-chloranyl-5-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-pyridazin-3-one Openeye Name: 4-chloro-5-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-pyridazin-3-one CAS Name: 4-chloro-5-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]-2-phenyl-3-pyridazinone IUPAC Name: 4-chloro-5-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenylpyridazin-3-one Traditional Name: 4-chloro-5-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]-2-phenyl-pyridazin-3-one Formula: C19H14ClN5OS MolecularWeight: 395.86536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC=CC=C2)SC3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl

Isomeric SMILES

CC1=NN=C(N1C2=CC=CC=C2)SC3=C(C(=O)N(N=C3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C19H14ClN5OS/c1-13-22-23-19(24(13)14-8-4-2-5-9-14)27-16-12-21-25(18(26)17(16)20)15-10-6-3-7-11-15/h2-12H,1H3