4-pyrimidin-2-ylsulfanyl-1-thiophen-2-yl-butan-1-one

Systemtic Name: 4-pyrimidin-2-ylsulfanyl-1-thiophen-2-yl-butan-1-one Openeye Name: 4-pyrimidin-2-ylsulfanyl-1-(2-thienyl)butan-1-one CAS Name: 4-(2-pyrimidinylthio)-1-thiophen-2-yl-1-butanone IUPAC Name: 4-pyrimidin-2-ylsulfanyl-1-thiophen-2-ylbutan-1-one Traditional Name: 4-(2-pyrimidylthio)-1-(2-thienyl)butan-1-one Formula: C12H12N2OS2 MolecularWeight: 264.36648

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCCCC(=O)C2=CC=CS2

Isomeric SMILES

C1=CN=C(N=C1)SCCCC(=O)C2=CC=CS2

InChI

InChI=1S/C12H12N2OS2/c15-10(11-5-2-8-16-11)4-1-9-17-12-13-6-3-7-14-12/h2-3,5-8H,1,4,9H2