6-(phenylmethyl)-7-[(4-piperidin-1-ylsulfonylphenyl)amino]-7H-pyrrolo[3,4-b]pyridin-5-one

Systemtic Name: 6-(phenylmethyl)-7-[(4-piperidin-1-ylsulfonylphenyl)amino]-7H-pyrrolo[3,4-b]pyridin-5-one Openeye Name: 6-benzyl-7-[4-(1-piperidylsulfonyl)anilino]-7H-pyrrolo[3,4-b]pyridin-5-one CAS Name: 6-(phenylmethyl)-7-[4-(1-piperidinylsulfonyl)anilino]-7H-pyrrolo[3,4-b]pyridin-5-one IUPAC Name: 6-benzyl-7-(4-piperidin-1-ylsulfonylanilino)-7H-pyrrolo[3,4-b]pyridin-5-one Traditional Name: 6-benzyl-7-(4-piperidinosulfonylanilino)-7H-pyrrolo[3,4-b]pyridin-5-one Formula: C25H26N4O3S MolecularWeight: 462.56394

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC3C4=C(C=CC=N4)C(=O)N3CC5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC3C4=C(C=CC=N4)C(=O)N3CC5=CC=CC=C5

InChI

InChI=1S/C25H26N4O3S/c30-25-22-10-7-15-26-23(22)24(29(25)18-19-8-3-1-4-9-19)27-20-11-13-21(14-12-20)33(31,32)28-16-5-2-6-17-28/h1,3-4,7-15,24,27H,2,5-6,16-18H2