4-ethoxy-3-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-[(1R,2S)-1-oxidanyl-1-phenyl-propan-2-yl]benzenesulfonamide

Systemtic Name: 4-ethoxy-3-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-[(1R,2S)-1-oxidanyl-1-phenyl-propan-2-yl]benzenesulfonamide Openeye Name: 4-ethoxy-N-[(1S,2R)-2-hydroxy-1-methyl-2-phenyl-ethyl]-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)benzenesulfonamide CAS Name: 4-ethoxy-N-[(1R,2S)-1-hydroxy-1-phenylpropan-2-yl]-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)benzenesulfonamide IUPAC Name: 4-ethoxy-N-[(1R,2S)-1-hydroxy-1-phenylpropan-2-yl]-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)benzenesulfonamide Traditional Name: 4-ethoxy-N-[(1S,2R)-2-hydroxy-1-methyl-2-phenyl-ethyl]-3-(7-keto-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)benzenesulfonamide Formula: C26H31N5O5S MolecularWeight: 525.61984

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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(C)C(C4=CC=CC=C4)O)OCC)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N[C@@H](C)[C@@H](C4=CC=CC=C4)O)OCC)C

InChI

InChI=1S/C26H31N5O5S/c1-5-10-20-22-23(31(4)29-20)26(33)28-25(27-22)19-15-18(13-14-21(19)36-6-2)37(34,35)30-16(3)24(32)17-11-8-7-9-12-17/h7-9,11-16,24,30,32H,5-6,10H2,1-4H3,(H,27,28,33)/t16-,24-/m0/s1