N-[3-(azepan-1-ylsulfonyl)phenyl]quinoline-8-carboxamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]quinoline-8-carboxamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]quinoline-8-carboxamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-8-quinolinecarboxamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]quinoline-8-carboxamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]quinoline-8-carboxamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C22H23N3O3S/c26-22(20-12-5-8-17-9-7-13-23-21(17)20)24-18-10-6-11-19(16-18)29(27,28)25-14-3-1-2-4-15-25/h5-13,16H,1-4,14-15H2,(H,24,26)