N-[6-(azepan-1-yl)pyridin-3-yl]sulfonyl-2-chloranyl-4-fluoranyl-benzamide

Systemtic Name: N-[6-(azepan-1-yl)pyridin-3-yl]sulfonyl-2-chloranyl-4-fluoranyl-benzamide Openeye Name: N-[[6-(azepan-1-yl)-3-pyridyl]sulfonyl]-2-chloro-4-fluoro-benzamide CAS Name: N-[[6-(1-azepanyl)-3-pyridinyl]sulfonyl]-2-chloro-4-fluorobenzamide IUPAC Name: N-[6-(azepan-1-yl)pyridin-3-yl]sulfonyl-2-chloro-4-fluorobenzamide Traditional Name: N-[[6-(azepan-1-yl)-3-pyridyl]sulfonyl]-2-chloro-4-fluoro-benzamide Formula: C18H19ClFN3O3S MolecularWeight: 411.878163

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19ClFN3O3S/c19-16-11-13(20)5-7-15(16)18(24)22-27(25,26)14-6-8-17(21-12-14)23-9-3-1-2-4-10-23/h5-8,11-12H,1-4,9-10H2,(H,22,24)