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

Systemtic Name: 5-ethoxy-4-(5-methyl-4-oxidanylidene-7-propyl-1H-pyrrolo[2,3-d]pyrimidin-2-yl)-2-[1-(phenylmethyl)piperidin-2-yl]benzenesulfonamide Openeye Name: 2-(1-benzyl-2-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-[1-(phenylmethyl)-2-piperidinyl]benzenesulfonamide IUPAC Name: 2-(1-benzylpiperidin-2-yl)-5-ethoxy-4-(5-methyl-4-oxo-7-propyl-1H-pyrrolo[2,3-d]pyrimidin-2-yl)benzenesulfonamide Traditional Name: 2-(1-benzyl-2-piperidyl)-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)C4CCCCN4CC5=CC=CC=C5)C

Isomeric SMILES

CCCN1C=C(C2=C1NC(=NC2=O)C3=CC(=C(C=C3OCC)S(=O)(=O)N)C4CCCCN4CC5=CC=CC=C5)C

InChI

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