3-[2-(4-bromanylpyrazol-1-yl)ethyl]-5-ethyl-6-methyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[2-(4-bromanylpyrazol-1-yl)ethyl]-5-ethyl-6-methyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-(4-bromopyrazol-1-yl)ethyl]-5-ethyl-6-methyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-(4-bromo-1-pyrazolyl)ethyl]-5-ethyl-6-methyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 3-[2-(4-bromopyrazol-1-yl)ethyl]-5-ethyl-6-methyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-(4-bromopyrazol-1-yl)ethyl]-5-ethyl-6-methyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one Formula: C14H15BrN4OS2 MolecularWeight: 399.3291

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)N(C(=S)N2)CCN3C=C(C=N3)Br)C

Isomeric SMILES

CCC1=C(SC2=C1C(=O)N(C(=S)N2)CCN3C=C(C=N3)Br)C

InChI

InChI=1S/C14H15BrN4OS2/c1-3-10-8(2)22-12-11(10)13(20)19(14(21)17-12)5-4-18-7-9(15)6-16-18/h6-7H,3-5H2,1-2H3,(H,17,21)