1-phenyl-N-[[4-(4-pyrrolidin-1-ylsulfonylphenyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]methyl]methanamine

Systemtic Name: 1-phenyl-N-[[4-(4-pyrrolidin-1-ylsulfonylphenyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]methyl]methanamine Openeye Name: 1-phenyl-N-[[4-(4-pyrrolidin-1-ylsulfonylphenyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]methyl]methanamine CAS Name: 1-phenyl-N-[[4-[4-(1-pyrrolidinylsulfonyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-2-yl]methyl]methanamine IUPAC Name: 1-phenyl-N-[[4-(4-pyrrolidin-1-ylsulfonylphenyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]methyl]methanamine Traditional Name: benzyl-[[4-(4-pyrrolidinosulfonylphenyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]methyl]amine Formula: C25H26N4O2S MolecularWeight: 446.56454

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=C4C=C(NC4=NC=C3)CNCC5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=C4C=C(NC4=NC=C3)CNCC5=CC=CC=C5

InChI

InChI=1S/C25H26N4O2S/c30-32(31,29-14-4-5-15-29)22-10-8-20(9-11-22)23-12-13-27-25-24(23)16-21(28-25)18-26-17-19-6-2-1-3-7-19/h1-3,6-13,16,26H,4-5,14-15,17-18H2,(H,27,28)