4-ethoxy-3-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-(phenylmethyl)-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide

Systemtic Name: 4-ethoxy-3-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-(phenylmethyl)-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide Openeye Name: N-benzyl-4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide CAS Name: 4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-(phenylmethyl)-N-[2-(1-pyrrolidinyl)ethyl]benzenesulfonamide IUPAC Name: N-benzyl-4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide Traditional Name: N-benzyl-4-ethoxy-3-(7-keto-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-(2-pyrrolidinoethyl)benzenesulfonamide Formula: C30H38N6O4S MolecularWeight: 578.72552

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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(CCN4CCCC4)CC5=CC=CC=C5)OCC)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N(CCN4CCCC4)CC5=CC=CC=C5)OCC)C

InChI

InChI=1S/C30H38N6O4S/c1-4-11-25-27-28(34(3)33-25)30(37)32-29(31-27)24-20-23(14-15-26(24)40-5-2)41(38,39)36(19-18-35-16-9-10-17-35)21-22-12-7-6-8-13-22/h6-8,12-15,20H,4-5,9-11,16-19,21H2,1-3H3,(H,31,32,37)