4-chloranyl-2-[[4-chloranyl-5-cyano-6-(4-methoxyphenyl)pyrimidin-2-yl]sulfanylmethylsulfanyl]-6-(4-methoxyphenyl)pyrimidine-5-carbonitrile

Systemtic Name: 4-chloranyl-2-[[4-chloranyl-5-cyano-6-(4-methoxyphenyl)pyrimidin-2-yl]sulfanylmethylsulfanyl]-6-(4-methoxyphenyl)pyrimidine-5-carbonitrile Openeye Name: 4-chloro-2-[[4-chloro-5-cyano-6-(4-methoxyphenyl)pyrimidin-2-yl]sulfanylmethylsulfanyl]-6-(4-methoxyphenyl)pyrimidine-5-carbonitrile CAS Name: 4-chloro-2-[[[4-chloro-5-cyano-6-(4-methoxyphenyl)-2-pyrimidinyl]thio]methylthio]-6-(4-methoxyphenyl)-5-pyrimidinecarbonitrile IUPAC Name: 4-chloro-2-[[4-chloro-5-cyano-6-(4-methoxyphenyl)pyrimidin-2-yl]sulfanylmethylsulfanyl]-6-(4-methoxyphenyl)pyrimidine-5-carbonitrile Traditional Name: 4-chloro-2-[[[4-chloro-5-cyano-6-(4-methoxyphenyl)pyrimidin-2-yl]thio]methylthio]-6-(4-methoxyphenyl)pyrimidine-5-carbonitrile Formula: C25H16Cl2N6O2S2 MolecularWeight: 567.46954

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=NC(=N2)SCSC3=NC(=C(C(=N3)Cl)C#N)C4=CC=C(C=C4)OC)Cl)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=NC(=N2)SCSC3=NC(=C(C(=N3)Cl)C#N)C4=CC=C(C=C4)OC)Cl)C#N

InChI

InChI=1S/C25H16Cl2N6O2S2/c1-34-16-7-3-14(4-8-16)20-18(11-28)22(26)32-24(30-20)36-13-37-25-31-21(19(12-29)23(27)33-25)15-5-9-17(35-2)10-6-15/h3-10H,13H2,1-2H3