6-azanyl-1-cyclopropyl-5-[2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylethanoyl]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-1-cyclopropyl-5-[2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylethanoyl]pyrimidine-2,4-dione Openeye Name: 6-amino-1-cyclopropyl-5-[2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylacetyl]pyrimidine-2,4-dione CAS Name: 6-amino-1-cyclopropyl-5-[2-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]-1-oxoethyl]pyrimidine-2,4-dione IUPAC Name: 6-amino-1-cyclopropyl-5-[2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylacetyl]pyrimidine-2,4-dione Traditional Name: 6-amino-1-cyclopropyl-5-[2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]acetyl]pyrimidine-2,4-quinone Formula: C15H15N7O3S MolecularWeight: 373.3897

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)SCC(=O)C3=C(N(C(=O)NC3=O)C4CC4)N

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)SCC(=O)C3=C(N(C(=O)NC3=O)C4CC4)N

InChI

InChI=1S/C15H15N7O3S/c1-21-12-8(4-19-21)14(18-6-17-12)26-5-9(23)10-11(16)22(7-2-3-7)15(25)20-13(10)24/h4,6-7H,2-3,5,16H2,1H3,(H,20,24,25)