1-(cyclohexylmethyl)-6-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridine-3-carbaldehyde

Systemtic Name: 1-(cyclohexylmethyl)-6-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridine-3-carbaldehyde Openeye Name: 1-(cyclohexylmethyl)-6-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridine-3-carbaldehyde CAS Name: 1-(cyclohexylmethyl)-6-(4-methylsulfonylphenyl)-3-pyrrolo[2,3-b]pyridinecarboxaldehyde IUPAC Name: 1-(cyclohexylmethyl)-6-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridine-3-carbaldehyde Traditional Name: 1-(cyclohexylmethyl)-6-(4-mesylphenyl)pyrrolo[2,3-b]pyridine-3-carbaldehyde Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=NC3=C(C=C2)C(=CN3CC4CCCCC4)C=O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=NC3=C(C=C2)C(=CN3CC4CCCCC4)C=O

InChI

InChI=1S/C22H24N2O3S/c1-28(26,27)19-9-7-17(8-10-19)21-12-11-20-18(15-25)14-24(22(20)23-21)13-16-5-3-2-4-6-16/h7-12,14-16H,2-6,13H2,1H3