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

Systemtic Name: 2-(2-ethyl-7-oxidanylidene-6-phenethyl-pyrazolo[4,3-d]pyrimidin-5-yl)sulfanyl-N-[(4-methylphenyl)methyl]ethanamide Openeye Name: 2-(2-ethyl-7-oxo-6-phenethyl-pyrazolo[4,3-d]pyrimidin-5-yl)sulfanyl-N-(p-tolylmethyl)acetamide CAS Name: 2-[(2-ethyl-7-oxo-6-phenethyl-5-pyrazolo[4,3-d]pyrimidinyl)thio]-N-[(4-methylphenyl)methyl]acetamide IUPAC Name: 2-(2-ethyl-7-oxo-6-phenethylpyrazolo[4,3-d]pyrimidin-5-yl)sulfanyl-N-[(4-methylphenyl)methyl]acetamide Traditional Name: 2-[(2-ethyl-7-keto-6-phenethyl-pyrazolo[4,3-d]pyrimidin-5-yl)thio]-N-(4-methylbenzyl)acetamide Formula: C25H27N5O2S MolecularWeight: 461.57918

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C2C(=N1)C(=O)N(C(=N2)SCC(=O)NCC3=CC=C(C=C3)C)CCC4=CC=CC=C4

Isomeric SMILES

CCN1C=C2C(=N1)C(=O)N(C(=N2)SCC(=O)NCC3=CC=C(C=C3)C)CCC4=CC=CC=C4

InChI

InChI=1S/C25H27N5O2S/c1-3-29-16-21-23(28-29)24(32)30(14-13-19-7-5-4-6-8-19)25(27-21)33-17-22(31)26-15-20-11-9-18(2)10-12-20/h4-12,16H,3,13-15,17H2,1-2H3,(H,26,31)