1-(4-methyl-3-nitro-phenyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanone

Systemtic Name: 1-(4-methyl-3-nitro-phenyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanone Openeye Name: 1-(4-methyl-3-nitro-phenyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanone CAS Name: 1-(4-methyl-3-nitrophenyl)-2-[(4-phenyl-1-phthalazinyl)thio]ethanone IUPAC Name: 1-(4-methyl-3-nitrophenyl)-2-(4-phenylphthalazin-1-yl)sulfanylethanone Traditional Name: 1-(4-methyl-3-nitro-phenyl)-2-[(4-phenylphthalazin-1-yl)thio]ethanone Formula: C23H17N3O3S MolecularWeight: 415.46438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H17N3O3S/c1-15-11-12-17(13-20(15)26(28)29)21(27)14-30-23-19-10-6-5-9-18(19)22(24-25-23)16-7-3-2-4-8-16/h2-13H,14H2,1H3