N-cyclopentyl-2-[2-ethyl-6-[(4-methylphenyl)methyl]-7-oxidanylidene-pyrazolo[4,3-d]pyrimidin-5-yl]sulfanyl-ethanamide

Systemtic Name: N-cyclopentyl-2-[2-ethyl-6-[(4-methylphenyl)methyl]-7-oxidanylidene-pyrazolo[4,3-d]pyrimidin-5-yl]sulfanyl-ethanamide Openeye Name: N-cyclopentyl-2-[2-ethyl-7-oxo-6-(p-tolylmethyl)pyrazolo[4,3-d]pyrimidin-5-yl]sulfanyl-acetamide CAS Name: N-cyclopentyl-2-[[2-ethyl-6-[(4-methylphenyl)methyl]-7-oxo-5-pyrazolo[4,3-d]pyrimidinyl]thio]acetamide IUPAC Name: N-cyclopentyl-2-[2-ethyl-6-[(4-methylphenyl)methyl]-7-oxopyrazolo[4,3-d]pyrimidin-5-yl]sulfanylacetamide Traditional Name: N-cyclopentyl-2-[[2-ethyl-7-keto-6-(4-methylbenzyl)pyrazolo[4,3-d]pyrimidin-5-yl]thio]acetamide Formula: C22H27N5O2S MolecularWeight: 425.54708

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C2C(=N1)C(=O)N(C(=N2)SCC(=O)NC3CCCC3)CC4=CC=C(C=C4)C

Isomeric SMILES

CCN1C=C2C(=N1)C(=O)N(C(=N2)SCC(=O)NC3CCCC3)CC4=CC=C(C=C4)C

InChI

InChI=1S/C22H27N5O2S/c1-3-26-13-18-20(25-26)21(29)27(12-16-10-8-15(2)9-11-16)22(24-18)30-14-19(28)23-17-6-4-5-7-17/h8-11,13,17H,3-7,12,14H2,1-2H3,(H,23,28)