5-[2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanylpyrimidin-4-yl]-2-methylsulfanyl-4-phenyl-thiophene-3-carbonitrile

Systemtic Name: 5-[2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanylpyrimidin-4-yl]-2-methylsulfanyl-4-phenyl-thiophene-3-carbonitrile Openeye Name: 5-[2-[2-(4-chlorophenyl)-2-oxo-ethyl]sulfanylpyrimidin-4-yl]-2-methylsulfanyl-4-phenyl-thiophene-3-carbonitrile CAS Name: 5-[2-[[2-(4-chlorophenyl)-2-oxoethyl]thio]-4-pyrimidinyl]-2-(methylthio)-4-phenyl-3-thiophenecarbonitrile IUPAC Name: 5-[2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanylpyrimidin-4-yl]-2-methylsulfanyl-4-phenylthiophene-3-carbonitrile Traditional Name: 5-[2-[[2-(4-chlorophenyl)-2-keto-ethyl]thio]pyrimidin-4-yl]-2-(methylthio)-4-phenyl-thiophene-3-carbonitrile Formula: C24H16ClN3OS3 MolecularWeight: 494.05134

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=C(S1)C2=NC(=NC=C2)SCC(=O)C3=CC=C(C=C3)Cl)C4=CC=CC=C4)C#N

Isomeric SMILES

CSC1=C(C(=C(S1)C2=NC(=NC=C2)SCC(=O)C3=CC=C(C=C3)Cl)C4=CC=CC=C4)C#N

InChI

InChI=1S/C24H16ClN3OS3/c1-30-23-18(13-26)21(16-5-3-2-4-6-16)22(32-23)19-11-12-27-24(28-19)31-14-20(29)15-7-9-17(25)10-8-15/h2-12H,14H2,1H3