3-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-(3-oxidanylpropyl)-N-(phenylmethyl)-4-propoxy-benzenesulfonamide

Systemtic Name: 3-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-(3-oxidanylpropyl)-N-(phenylmethyl)-4-propoxy-benzenesulfonamide Openeye Name: N-benzyl-N-(3-hydroxypropyl)-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-propoxy-benzenesulfonamide CAS Name: N-(3-hydroxypropyl)-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-(phenylmethyl)-4-propoxybenzenesulfonamide IUPAC Name: N-benzyl-N-(3-hydroxypropyl)-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-propoxybenzenesulfonamide Traditional Name: N-benzyl-N-(3-hydroxypropyl)-3-(7-keto-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-propoxy-benzenesulfonamide Formula: C28H35N5O5S MolecularWeight: 553.673

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N(CCCO)CC4=CC=CC=C4)OCCC)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N(CCCO)CC4=CC=CC=C4)OCCC)C

InChI

InChI=1S/C28H35N5O5S/c1-4-10-23-25-26(32(3)31-23)28(35)30-27(29-25)22-18-21(13-14-24(22)38-17-5-2)39(36,37)33(15-9-16-34)19-20-11-7-6-8-12-20/h6-8,11-14,18,34H,4-5,9-10,15-17,19H2,1-3H3,(H,29,30,35)