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

Systemtic Name: 5-(azepan-1-ylsulfonyl)-2-pyridin-3-yl-1H-indole-3-carbaldehyde Openeye Name: 5-(azepan-1-ylsulfonyl)-2-(3-pyridyl)-1H-indole-3-carbaldehyde CAS Name: 5-(1-azepanylsulfonyl)-2-(3-pyridinyl)-1H-indole-3-carboxaldehyde IUPAC Name: 5-(azepan-1-ylsulfonyl)-2-pyridin-3-yl-1H-indole-3-carbaldehyde Traditional Name: 5-(azepan-1-ylsulfonyl)-2-(3-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=CN=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O3S/c24-14-18-17-12-16(27(25,26)23-10-3-1-2-4-11-23)7-8-19(17)22-20(18)15-6-5-9-21-13-15/h5-9,12-14,22H,1-4,10-11H2