N-[3-(azepan-1-ylsulfonyl)phenyl]-5,6-bis(chloranyl)pyridine-3-carboxamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-5,6-bis(chloranyl)pyridine-3-carboxamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-5,6-dichloro-pyridine-3-carboxamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-5,6-dichloro-3-pyridinecarboxamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-5,6-dichloropyridine-3-carboxamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-5,6-dichloro-nicotinamide Formula: C18H19Cl2N3O3S MolecularWeight: 428.33276

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC(=C(N=C3)Cl)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=CC(=C(N=C3)Cl)Cl

InChI

InChI=1S/C18H19Cl2N3O3S/c19-16-10-13(12-21-17(16)20)18(24)22-14-6-5-7-15(11-14)27(25,26)23-8-3-1-2-4-9-23/h5-7,10-12H,1-4,8-9H2,(H,22,24)