[1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-4,6-bis(oxidanylidene)-3-phenyl-2-sulfanylidene-1,3-diazinan-5-yl]-phenyl-mercury

Systemtic Name: [1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-4,6-bis(oxidanylidene)-3-phenyl-2-sulfanylidene-1,3-diazinan-5-yl]-phenyl-mercury Openeye Name: [1-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-4,6-dioxo-3-phenyl-2-thioxo-hexahydropyrimidin-5-yl]-phenyl-mercury CAS Name: [1-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-4,6-dioxo-3-phenyl-2-sulfanylidene-1,3-diazinan-5-yl]-phenylmercury IUPAC Name: [1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4,6-dioxo-3-phenyl-2-sulfanylidene-1,3-diazinan-5-yl]-phenylmercury Traditional Name: [4,6-diketo-1-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-3-phenyl-2-thioxo-hexahydropyrimidin-5-yl]-phenyl-mercury Formula: C27H22HgN4O3S MolecularWeight: 683.14358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N3C(=O)C(C(=O)N(C3=S)C4=CC=CC=C4)[Hg]C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N3C(=O)C(C(=O)N(C3=S)C4=CC=CC=C4)[Hg]C5=CC=CC=C5

InChI

InChI=1S/C21H17N4O3S.C6H5.Hg/c1-14-19(20(28)25(22(14)2)16-11-7-4-8-12-16)24-18(27)13-17(26)23(21(24)29)15-9-5-3-6-10-15;1-2-4-6-5-3-1;/h3-13H,1-2H3;1-5H;