5-(azepan-1-ylsulfonyl)-2-pyridin-2-yl-1H-indole-3-carbaldehyde

Systemtic Name: 5-(azepan-1-ylsulfonyl)-2-pyridin-2-yl-1H-indole-3-carbaldehyde Openeye Name: 5-(azepan-1-ylsulfonyl)-2-(2-pyridyl)-1H-indole-3-carbaldehyde CAS Name: 5-(1-azepanylsulfonyl)-2-(2-pyridinyl)-1H-indole-3-carboxaldehyde IUPAC Name: 5-(azepan-1-ylsulfonyl)-2-pyridin-2-yl-1H-indole-3-carbaldehyde Traditional Name: 5-(azepan-1-ylsulfonyl)-2-(2-pyridyl)-1H-indole-3-carbaldehyde Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)NC(=C3C=O)C4=CC=CC=N4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)NC(=C3C=O)C4=CC=CC=N4

InChI

InChI=1S/C20H21N3O3S/c24-14-17-16-13-15(27(25,26)23-11-5-1-2-6-12-23)8-9-18(16)22-20(17)19-7-3-4-10-21-19/h3-4,7-10,13-14,22H,1-2,5-6,11-12H2