2-[4-methyl-5,7-bis(oxidanylidene)-1-phenethyl-pyrazolo[4,3-d]pyrimidin-3-yl]sulfanylethanamide

Systemtic Name: 2-[4-methyl-5,7-bis(oxidanylidene)-1-phenethyl-pyrazolo[4,3-d]pyrimidin-3-yl]sulfanylethanamide Openeye Name: 2-(4-methyl-5,7-dioxo-1-phenethyl-pyrazolo[4,3-d]pyrimidin-3-yl)sulfanylacetamide CAS Name: 2-[(4-methyl-5,7-dioxo-1-phenethyl-3-pyrazolo[4,3-d]pyrimidinyl)thio]acetamide IUPAC Name: 2-(4-methyl-5,7-dioxo-1-phenethylpyrazolo[4,3-d]pyrimidin-3-yl)sulfanylacetamide Traditional Name: 2-[(5,7-diketo-4-methyl-1-phenethyl-pyrazolo[4,3-d]pyrimidin-3-yl)thio]acetamide Formula: C16H17N5O3S MolecularWeight: 359.40288

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(N=C2SCC(=O)N)CCC3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(N=C2SCC(=O)N)CCC3=CC=CC=C3

InChI

InChI=1S/C16H17N5O3S/c1-20-13-12(14(23)18-16(20)24)21(19-15(13)25-9-11(17)22)8-7-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H2,17,22)(H,18,23,24)