3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(2-thiophen-2-ylethyl)-N-(thiophen-2-ylmethyl)propanamide

Systemtic Name: 3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(2-thiophen-2-ylethyl)-N-(thiophen-2-ylmethyl)propanamide Openeye Name: 3-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)-N-[2-(2-thienyl)ethyl]-N-(2-thienylmethyl)propanamide CAS Name: 3-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)-N-(2-thiophen-2-ylethyl)-N-(thiophen-2-ylmethyl)propanamide IUPAC Name: 3-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)-N-(2-thiophen-2-ylethyl)-N-(thiophen-2-ylmethyl)propanamide Traditional Name: 3-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(2-thenyl)-N-[2-(2-thienyl)ethyl]propionamide Formula: C20H21N5O2S2 MolecularWeight: 427.54304

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=O)N(C=N2)CCC(=O)N(CCC3=CC=CS3)CC4=CC=CS4

Isomeric SMILES

CN1C2=C(C=N1)C(=O)N(C=N2)CCC(=O)N(CCC3=CC=CS3)CC4=CC=CS4

InChI

InChI=1S/C20H21N5O2S2/c1-23-19-17(12-22-23)20(27)25(14-21-19)9-7-18(26)24(13-16-5-3-11-29-16)8-6-15-4-2-10-28-15/h2-5,10-12,14H,6-9,13H2,1H3