2-[2-ethyl-6-[(4-methoxyphenyl)methyl]-7-oxidanylidene-pyrazolo[4,3-d]pyrimidin-5-yl]sulfanylethanamide

Systemtic Name: 2-[2-ethyl-6-[(4-methoxyphenyl)methyl]-7-oxidanylidene-pyrazolo[4,3-d]pyrimidin-5-yl]sulfanylethanamide Openeye Name: 2-[2-ethyl-6-[(4-methoxyphenyl)methyl]-7-oxo-pyrazolo[4,3-d]pyrimidin-5-yl]sulfanylacetamide CAS Name: 2-[[2-ethyl-6-[(4-methoxyphenyl)methyl]-7-oxo-5-pyrazolo[4,3-d]pyrimidinyl]thio]acetamide IUPAC Name: 2-[2-ethyl-6-[(4-methoxyphenyl)methyl]-7-oxopyrazolo[4,3-d]pyrimidin-5-yl]sulfanylacetamide Traditional Name: 2-[(2-ethyl-7-keto-6-p-anisyl-pyrazolo[4,3-d]pyrimidin-5-yl)thio]acetamide Formula: C17H19N5O3S MolecularWeight: 373.42946

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C2C(=N1)C(=O)N(C(=N2)SCC(=O)N)CC3=CC=C(C=C3)OC

Isomeric SMILES

CCN1C=C2C(=N1)C(=O)N(C(=N2)SCC(=O)N)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C17H19N5O3S/c1-3-21-9-13-15(20-21)16(24)22(17(19-13)26-10-14(18)23)8-11-4-6-12(25-2)7-5-11/h4-7,9H,3,8,10H2,1-2H3,(H2,18,23)