5-[(4-azanyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-1,2-dihydropyrazol-3-one

Systemtic Name: 5-[(4-azanyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-1,2-dihydropyrazol-3-one Openeye Name: 5-[(4-amino-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-1,2-dihydropyrazol-3-one CAS Name: 5-[[(4-amino-5,6-dimethyl-2-thieno[2,3-d]pyrimidinyl)thio]methyl]-1,2-dihydropyrazol-3-one IUPAC Name: 5-[(4-amino-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-1,2-dihydropyrazol-3-one Traditional Name: 5-[[(4-amino-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)thio]methyl]-3-pyrazolin-3-one Formula: C12H13N5OS2 MolecularWeight: 307.39452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N)SCC3=CC(=O)NN3)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N)SCC3=CC(=O)NN3)C

InChI

InChI=1S/C12H13N5OS2/c1-5-6(2)20-11-9(5)10(13)14-12(15-11)19-4-7-3-8(18)17-16-7/h3H,4H2,1-2H3,(H2,13,14,15)(H2,16,17,18)