2-cyclohexyl-N-[(4-methylsulfonylphenyl)methyl]-6-(3-phenylpyrrolo[2,3-b]pyridin-1-yl)hexanamide

Systemtic Name: 2-cyclohexyl-N-[(4-methylsulfonylphenyl)methyl]-6-(3-phenylpyrrolo[2,3-b]pyridin-1-yl)hexanamide Openeye Name: 2-cyclohexyl-N-[(4-methylsulfonylphenyl)methyl]-6-(3-phenylpyrrolo[2,3-b]pyridin-1-yl)hexanamide CAS Name: 2-cyclohexyl-N-[(4-methylsulfonylphenyl)methyl]-6-(3-phenyl-1-pyrrolo[2,3-b]pyridinyl)hexanamide IUPAC Name: 2-cyclohexyl-N-[(4-methylsulfonylphenyl)methyl]-6-(3-phenylpyrrolo[2,3-b]pyridin-1-yl)hexanamide Traditional Name: 2-cyclohexyl-N-(4-mesylbenzyl)-6-(3-phenylpyrrolo[2,3-b]pyridin-1-yl)hexanamide Formula: C33H39N3O3S MolecularWeight: 557.74606

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CNC(=O)C(CCCCN2C=C(C3=C2N=CC=C3)C4=CC=CC=C4)C5CCCCC5

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CNC(=O)C(CCCCN2C=C(C3=C2N=CC=C3)C4=CC=CC=C4)C5CCCCC5

InChI

InChI=1S/C33H39N3O3S/c1-40(38,39)28-19-17-25(18-20-28)23-35-33(37)29(26-11-4-2-5-12-26)15-8-9-22-36-24-31(27-13-6-3-7-14-27)30-16-10-21-34-32(30)36/h3,6-7,10,13-14,16-21,24,26,29H,2,4-5,8-9,11-12,15,22-23H2,1H3,(H,35,37)