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

Systemtic Name: 4-ethoxy-3-[1-methyl-3-(2-methylpropyl)-7-oxidanylidene-4H-pyrazolo[4,3-d]pyrimidin-5-yl]-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-4-ethoxy-3-(3-isobutyl-1-methyl-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-5-yl)benzenesulfonamide CAS Name: 4-ethoxy-3-[1-methyl-3-(2-methylpropyl)-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-5-yl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-4-ethoxy-3-[1-methyl-3-(2-methylpropyl)-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-5-yl]benzenesulfonamide Traditional Name: N-benzyl-4-ethoxy-3-(3-isobutyl-7-keto-1-methyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)benzenesulfonamide Formula: C25H29N5O4S MolecularWeight: 495.59386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=CC=C2)C3=NC(=O)C4=C(N3)C(=NN4C)CC(C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=CC=C2)C3=NC(=O)C4=C(N3)C(=NN4C)CC(C)C

InChI

InChI=1S/C25H29N5O4S/c1-5-34-21-12-11-18(35(32,33)26-15-17-9-7-6-8-10-17)14-19(21)24-27-22-20(13-16(2)3)29-30(4)23(22)25(31)28-24/h6-12,14,16,26H,5,13,15H2,1-4H3,(H,27,28,31)