6-[(4-chlorophenyl)methyl]-2-ethyl-5-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 6-[(4-chlorophenyl)methyl]-2-ethyl-5-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 6-[(4-chlorophenyl)methyl]-2-ethyl-5-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 6-[(4-chlorophenyl)methyl]-2-ethyl-5-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]-7-pyrazolo[4,3-d]pyrimidinone IUPAC Name: 6-[(4-chlorophenyl)methyl]-2-ethyl-5-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylpyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 6-(4-chlorobenzyl)-2-ethyl-5-[(2-keto-2-pyrrolidino-ethyl)thio]pyrazolo[4,3-d]pyrimidin-7-one Formula: C20H22ClN5O2S MolecularWeight: 431.93898

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C2C(=N1)C(=O)N(C(=N2)SCC(=O)N3CCCC3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CCN1C=C2C(=N1)C(=O)N(C(=N2)SCC(=O)N3CCCC3)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H22ClN5O2S/c1-2-25-12-16-18(23-25)19(28)26(11-14-5-7-15(21)8-6-14)20(22-16)29-13-17(27)24-9-3-4-10-24/h5-8,12H,2-4,9-11,13H2,1H3