4-chloranyl-7-methyl-6-thiabicyclo[3.1.1]hepta-1(7),2,4-triene; 2-sulfanylidene-1H-pyrimidin-4-one

Systemtic Name: 4-chloranyl-7-methyl-6-thiabicyclo[3.1.1]hepta-1(7),2,4-triene; 2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 4-chloro-7-methyl-6-thiabicyclo[3.1.1]hepta-1(7),2,4-triene; 2-thioxo-1H-pyrimidin-4-one CAS Name: 4-chloro-7-methyl-6-thiabicyclo[3.1.1]hepta-1(7),2,4-triene; 2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 4-chloro-7-methyl-6-thiabicyclo[3.1.1]hepta-1(7),2,4-triene; 2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 4-chloro-7-methyl-6-thiabicyclo[3.1.1]hepta-1(7),2,4-triene; 2-thioxo-1H-pyrimidin-4-one Formula: C11H9ClN2OS2 MolecularWeight: 284.78496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC(=C1S2)Cl.C1=CNC(=S)NC1=O

Isomeric SMILES

CC1=C2C=CC(=C1S2)Cl.C1=CNC(=S)NC1=O

InChI

InChI=1S/C7H5ClS.C4H4N2OS/c1-4-6-3-2-5(8)7(4)9-6;7-3-1-2-5-4(8)6-3/h2-3H,1H3;1-2H,(H2,5,6,7,8)