4-tert-butyl-N-[4-ethoxy-3-(1-ethyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]sulfonyl-benzamide

Systemtic Name: 4-tert-butyl-N-[4-ethoxy-3-(1-ethyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]sulfonyl-benzamide Openeye Name: 4-tert-butyl-N-[4-ethoxy-3-(1-ethyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]sulfonyl-benzamide CAS Name: 4-tert-butyl-N-[4-ethoxy-3-(1-ethyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]sulfonylbenzamide IUPAC Name: 4-tert-butyl-N-[4-ethoxy-3-(1-ethyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]sulfonylbenzamide Traditional Name: 4-tert-butyl-N-[4-ethoxy-3-(1-ethyl-7-keto-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]sulfonyl-benzamide Formula: C29H35N5O5S MolecularWeight: 565.6837

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)NC(=O)C4=CC=C(C=C4)C(C)(C)C)OCC)CC

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)NC(=O)C4=CC=C(C=C4)C(C)(C)C)OCC)CC

InChI

InChI=1S/C29H35N5O5S/c1-7-10-22-24-25(34(8-2)32-22)28(36)31-26(30-24)21-17-20(15-16-23(21)39-9-3)40(37,38)33-27(35)18-11-13-19(14-12-18)29(4,5)6/h11-17H,7-10H2,1-6H3,(H,33,35)(H,30,31,36)