4-[[1-(4-methoxyphenyl)-4,6-bis(oxidanylidene)-3-phenyl-2-sulfanylidene-1,3-diazinan-5-yl]diazenyl]-N-pyrimidin-2-yl-benzenesulfonamide

Systemtic Name: 4-[[1-(4-methoxyphenyl)-4,6-bis(oxidanylidene)-3-phenyl-2-sulfanylidene-1,3-diazinan-5-yl]diazenyl]-N-pyrimidin-2-yl-benzenesulfonamide Openeye Name: 4-[1-(4-methoxyphenyl)-4,6-dioxo-3-phenyl-2-thioxo-hexahydropyrimidin-5-yl]azo-N-pyrimidin-2-yl-benzenesulfonamide CAS Name: 4-[[1-(4-methoxyphenyl)-4,6-dioxo-3-phenyl-2-sulfanylidene-1,3-diazinan-5-yl]azo]-N-(2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[[1-(4-methoxyphenyl)-4,6-dioxo-3-phenyl-2-sulfanylidene-1,3-diazinan-5-yl]diazenyl]-N-pyrimidin-2-ylbenzenesulfonamide Traditional Name: 4-[4,6-diketo-1-(4-methoxyphenyl)-3-phenyl-2-thioxo-hexahydropyrimidin-5-yl]azo-N-(2-pyrimidyl)benzenesulfonamide Formula: C27H21N7O5S2 MolecularWeight: 587.62954

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C(C(=O)N(C2=S)C3=CC=CC=C3)N=NC4=CC=C(C=C4)S(=O)(=O)NC5=NC=CC=N5

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C(C(=O)N(C2=S)C3=CC=CC=C3)N=NC4=CC=C(C=C4)S(=O)(=O)NC5=NC=CC=N5

InChI

InChI=1S/C27H21N7O5S2/c1-39-21-12-10-20(11-13-21)34-25(36)23(24(35)33(27(34)40)19-6-3-2-4-7-19)31-30-18-8-14-22(15-9-18)41(37,38)32-26-28-16-5-17-29-26/h2-17,23H,1H3,(H,28,29,32)