N-[4-(azepan-1-ylsulfonyl)phenyl]-5,6-bis(chloranyl)pyridine-3-carboxamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-5,6-bis(chloranyl)pyridine-3-carboxamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-5,6-dichloro-pyridine-3-carboxamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-5,6-dichloro-3-pyridinecarboxamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-5,6-dichloropyridine-3-carboxamide Traditional Name: N-[4-(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=C(C=C2)NC(=O)C3=CC(=C(N=C3)Cl)Cl

Isomeric SMILES

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

InChI

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