3-(1-methylazepan-4-yl)-1-naphthalen-1-ylsulfonyl-pyrrolo[2,3-b]pyridine

Systemtic Name: 3-(1-methylazepan-4-yl)-1-naphthalen-1-ylsulfonyl-pyrrolo[2,3-b]pyridine Openeye Name: 3-(1-methylazepan-4-yl)-1-(1-naphthylsulfonyl)pyrrolo[2,3-b]pyridine CAS Name: 3-(1-methyl-4-azepanyl)-1-(1-naphthalenylsulfonyl)pyrrolo[2,3-b]pyridine IUPAC Name: 3-(1-methylazepan-4-yl)-1-naphthalen-1-ylsulfonylpyrrolo[2,3-b]pyridine Traditional Name: 3-(1-methylazepan-4-yl)-1-(1-naphthylsulfonyl)pyrrolo[2,3-b]pyridine Formula: C24H25N3O2S MolecularWeight: 419.5392

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(CC1)C2=CN(C3=C2C=CC=N3)S(=O)(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CN1CCCC(CC1)C2=CN(C3=C2C=CC=N3)S(=O)(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C24H25N3O2S/c1-26-15-6-9-19(13-16-26)22-17-27(24-21(22)11-5-14-25-24)30(28,29)23-12-4-8-18-7-2-3-10-20(18)23/h2-5,7-8,10-12,14,17,19H,6,9,13,15-16H2,1H3