5-ethoxy-4-(5-methyl-4-oxidanylidene-7-propyl-1H-pyrrolo[2,3-d]pyrimidin-2-yl)-2-[2-(phenylmethyl)piperidin-1-yl]benzenesulfonamide

Systemtic Name: 5-ethoxy-4-(5-methyl-4-oxidanylidene-7-propyl-1H-pyrrolo[2,3-d]pyrimidin-2-yl)-2-[2-(phenylmethyl)piperidin-1-yl]benzenesulfonamide Openeye Name: 2-(2-benzyl-1-piperidyl)-5-ethoxy-4-(5-methyl-4-oxo-7-propyl-1H-pyrrolo[2,3-d]pyrimidin-2-yl)benzenesulfonamide CAS Name: 5-ethoxy-4-(5-methyl-4-oxo-7-propyl-1H-pyrrolo[2,3-d]pyrimidin-2-yl)-2-[2-(phenylmethyl)-1-piperidinyl]benzenesulfonamide IUPAC Name: 2-(2-benzylpiperidin-1-yl)-5-ethoxy-4-(5-methyl-4-oxo-7-propyl-1H-pyrrolo[2,3-d]pyrimidin-2-yl)benzenesulfonamide Traditional Name: 2-(2-benzylpiperidino)-5-ethoxy-4-(4-keto-5-methyl-7-propyl-1H-pyrrolo[2,3-d]pyrimidin-2-yl)benzenesulfonamide Formula: C30H37N5O4S MolecularWeight: 563.71088

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C2=C1NC(=NC2=O)C3=CC(=C(C=C3OCC)S(=O)(=O)N)N4CCCCC4CC5=CC=CC=C5)C

Isomeric SMILES

CCCN1C=C(C2=C1NC(=NC2=O)C3=CC(=C(C=C3OCC)S(=O)(=O)N)N4CCCCC4CC5=CC=CC=C5)C

InChI

InChI=1S/C30H37N5O4S/c1-4-14-34-19-20(3)27-29(34)32-28(33-30(27)36)23-17-24(26(40(31,37)38)18-25(23)39-5-2)35-15-10-9-13-22(35)16-21-11-7-6-8-12-21/h6-8,11-12,17-19,22H,4-5,9-10,13-16H2,1-3H3,(H2,31,37,38)(H,32,33,36)