5-[(6-methylthieno[2,3-d]pyrimidin-4-yl)-sulfanyl-methyl]-1,2-dihydropyrazol-3-one

Systemtic Name: 5-[(6-methylthieno[2,3-d]pyrimidin-4-yl)-sulfanyl-methyl]-1,2-dihydropyrazol-3-one Openeye Name: 5-[(6-methylthieno[2,3-d]pyrimidin-4-yl)-sulfanyl-methyl]-1,2-dihydropyrazol-3-one CAS Name: 5-[mercapto-(6-methyl-4-thieno[2,3-d]pyrimidinyl)methyl]-1,2-dihydropyrazol-3-one IUPAC Name: 5-[(6-methylthieno[2,3-d]pyrimidin-4-yl)-sulfanylmethyl]-1,2-dihydropyrazol-3-one Traditional Name: 5-[mercapto-(6-methylthieno[2,3-d]pyrimidin-4-yl)methyl]-3-pyrazolin-3-one Formula: C11H10N4OS2 MolecularWeight: 278.3533

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(N=CN=C2S1)C(C3=CC(=O)NN3)S

Isomeric SMILES

CC1=CC2=C(N=CN=C2S1)C(C3=CC(=O)NN3)S

InChI

InChI=1S/C11H10N4OS2/c1-5-2-6-9(12-4-13-11(6)18-5)10(17)7-3-8(16)15-14-7/h2-4,10,17H,1H3,(H2,14,15,16)