2-methylsulfanyl-4-phenyl-5-[2-[2-[5-(trifluoromethyl)pyridin-2-yl]sulfonylethylsulfanyl]pyrimidin-4-yl]thiophene-3-carbonitrile

Systemtic Name: 2-methylsulfanyl-4-phenyl-5-[2-[2-[5-(trifluoromethyl)pyridin-2-yl]sulfonylethylsulfanyl]pyrimidin-4-yl]thiophene-3-carbonitrile Openeye Name: 2-methylsulfanyl-4-phenyl-5-[2-[2-[[5-(trifluoromethyl)-2-pyridyl]sulfonyl]ethylsulfanyl]pyrimidin-4-yl]thiophene-3-carbonitrile CAS Name: 2-(methylthio)-4-phenyl-5-[2-[2-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]ethylthio]-4-pyrimidinyl]-3-thiophenecarbonitrile IUPAC Name: 2-methylsulfanyl-4-phenyl-5-[2-[2-[5-(trifluoromethyl)pyridin-2-yl]sulfonylethylsulfanyl]pyrimidin-4-yl]thiophene-3-carbonitrile Traditional Name: 2-(methylthio)-4-phenyl-5-[2-[2-[[5-(trifluoromethyl)-2-pyridyl]sulfonyl]ethylthio]pyrimidin-4-yl]thiophene-3-carbonitrile Formula: C24H17F3N4O2S4 MolecularWeight: 578.67259

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=C(S1)C2=NC(=NC=C2)SCCS(=O)(=O)C3=NC=C(C=C3)C(F)(F)F)C4=CC=CC=C4)C#N

Isomeric SMILES

CSC1=C(C(=C(S1)C2=NC(=NC=C2)SCCS(=O)(=O)C3=NC=C(C=C3)C(F)(F)F)C4=CC=CC=C4)C#N

InChI

InChI=1S/C24H17F3N4O2S4/c1-34-22-17(13-28)20(15-5-3-2-4-6-15)21(36-22)18-9-10-29-23(31-18)35-11-12-37(32,33)19-8-7-16(14-30-19)24(25,26)27/h2-10,14H,11-12H2,1H3