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

Systemtic Name: 1-butyl-6-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridine Openeye Name: 1-butyl-6-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridine CAS Name: 1-butyl-6-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridine IUPAC Name: 1-butyl-6-(4-methylsulfonylphenyl)pyrrolo[2,3-b]pyridine Traditional Name: 1-butyl-6-(4-mesylphenyl)pyrrolo[2,3-b]pyridine Formula: C18H20N2O2S MolecularWeight: 328.4286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=CC2=C1N=C(C=C2)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCCCN1C=CC2=C1N=C(C=C2)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C18H20N2O2S/c1-3-4-12-20-13-11-15-7-10-17(19-18(15)20)14-5-8-16(9-6-14)23(2,21)22/h5-11,13H,3-4,12H2,1-2H3