5-methyl-1,4-bis[(2-nitrophenyl)sulfanyl]-2-phenyl-pyrazol-3-one

Systemtic Name: 5-methyl-1,4-bis[(2-nitrophenyl)sulfanyl]-2-phenyl-pyrazol-3-one Openeye Name: 5-methyl-1,4-bis[(2-nitrophenyl)sulfanyl]-2-phenyl-pyrazol-3-one CAS Name: 5-methyl-1,4-bis[(2-nitrophenyl)thio]-2-phenyl-3-pyrazolone IUPAC Name: 5-methyl-1,4-bis[(2-nitrophenyl)sulfanyl]-2-phenylpyrazol-3-one Traditional Name: 5-methyl-1,4-bis[(2-nitrophenyl)thio]-2-phenyl-3-pyrazolin-3-one Formula: C22H16N4O5S2 MolecularWeight: 480.51624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1SC2=CC=CC=C2[N+](=O)[O-])C3=CC=CC=C3)SC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=O)N(N1SC2=CC=CC=C2[N+](=O)[O-])C3=CC=CC=C3)SC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H16N4O5S2/c1-15-21(32-19-13-7-5-11-17(19)25(28)29)22(27)23(16-9-3-2-4-10-16)24(15)33-20-14-8-6-12-18(20)26(30)31/h2-14H,1H3