2-[4-(4-cyano-5-methylsulfanyl-3-phenyl-thiophen-2-yl)pyrimidin-2-yl]sulfanylethanamide

Systemtic Name: 2-[4-(4-cyano-5-methylsulfanyl-3-phenyl-thiophen-2-yl)pyrimidin-2-yl]sulfanylethanamide Openeye Name: 2-[4-(4-cyano-5-methylsulfanyl-3-phenyl-2-thienyl)pyrimidin-2-yl]sulfanylacetamide CAS Name: 2-[[4-[4-cyano-5-(methylthio)-3-phenyl-2-thiophenyl]-2-pyrimidinyl]thio]acetamide IUPAC Name: 2-[4-(4-cyano-5-methylsulfanyl-3-phenylthiophen-2-yl)pyrimidin-2-yl]sulfanylacetamide Traditional Name: 2-[[4-[4-cyano-5-(methylthio)-3-phenyl-2-thienyl]pyrimidin-2-yl]thio]acetamide Formula: C18H14N4OS3 MolecularWeight: 398.52496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14N4OS3/c1-24-17-12(9-19)15(11-5-3-2-4-6-11)16(26-17)13-7-8-21-18(22-13)25-10-14(20)23/h2-8H,10H2,1H3,(H2,20,23)