2-[(5-chloranyl-4-ethylsulfanyl-pyrimidin-2-yl)methylsulfinyl]-1H-thieno[3,4-d]imidazole

Systemtic Name: 2-[(5-chloranyl-4-ethylsulfanyl-pyrimidin-2-yl)methylsulfinyl]-1H-thieno[3,4-d]imidazole Openeye Name: 2-[(5-chloro-4-ethylsulfanyl-pyrimidin-2-yl)methylsulfinyl]-1H-thieno[3,4-d]imidazole CAS Name: 2-[[5-chloro-4-(ethylthio)-2-pyrimidinyl]methylsulfinyl]-1H-thieno[3,4-d]imidazole IUPAC Name: 2-[(5-chloro-4-ethylsulfanylpyrimidin-2-yl)methylsulfinyl]-1H-thieno[3,4-d]imidazole Traditional Name: 2-[[5-chloro-4-(ethylthio)pyrimidin-2-yl]methylsulfinyl]-1H-thien[3,4-d]imidazole Formula: C12H11ClN4OS3 MolecularWeight: 358.88994

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC(=NC=C1Cl)CS(=O)C2=NC3=CSC=C3N2

Isomeric SMILES

CCSC1=NC(=NC=C1Cl)CS(=O)C2=NC3=CSC=C3N2

InChI

InChI=1S/C12H11ClN4OS3/c1-2-20-11-7(13)3-14-10(17-11)6-21(18)12-15-8-4-19-5-9(8)16-12/h3-5H,2,6H2,1H3,(H,15,16)