2-methylsulfanyl-5-(2-phenacylsulfanylpyrimidin-4-yl)-4-phenyl-thiophene-3-carbonitrile

Systemtic Name: 2-methylsulfanyl-5-(2-phenacylsulfanylpyrimidin-4-yl)-4-phenyl-thiophene-3-carbonitrile Openeye Name: 2-methylsulfanyl-5-(2-phenacylsulfanylpyrimidin-4-yl)-4-phenyl-thiophene-3-carbonitrile CAS Name: 2-(methylthio)-5-[2-(phenacylthio)-4-pyrimidinyl]-4-phenyl-3-thiophenecarbonitrile IUPAC Name: 2-methylsulfanyl-5-(2-phenacylsulfanylpyrimidin-4-yl)-4-phenylthiophene-3-carbonitrile Traditional Name: 2-(methylthio)-5-[2-(phenacylthio)pyrimidin-4-yl]-4-phenyl-thiophene-3-carbonitrile Formula: C24H17N3OS3 MolecularWeight: 459.60628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H17N3OS3/c1-29-23-18(14-25)21(17-10-6-3-7-11-17)22(31-23)19-12-13-26-24(27-19)30-15-20(28)16-8-4-2-5-9-16/h2-13H,15H2,1H3