4-chloranyl-N-[(6-chloranylpyridin-3-yl)methyl]-N-[(3R)-2-oxidanylideneazepan-3-yl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[(6-chloranylpyridin-3-yl)methyl]-N-[(3R)-2-oxidanylideneazepan-3-yl]benzenesulfonamide Openeye Name: 4-chloro-N-[(6-chloro-3-pyridyl)methyl]-N-[(3R)-2-oxoazepan-3-yl]benzenesulfonamide CAS Name: 4-chloro-N-[(6-chloro-3-pyridinyl)methyl]-N-[(3R)-2-oxo-3-azepanyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[(6-chloropyridin-3-yl)methyl]-N-[(3R)-2-oxoazepan-3-yl]benzenesulfonamide Traditional Name: 4-chloro-N-[(6-chloro-3-pyridyl)methyl]-N-[(3R)-2-ketoazepan-3-yl]benzenesulfonamide Formula: C18H19Cl2N3O3S MolecularWeight: 428.33276

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)N(CC2=CN=C(C=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCNC(=O)[C@@H](C1)N(CC2=CN=C(C=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H19Cl2N3O3S/c19-14-5-7-15(8-6-14)27(25,26)23(12-13-4-9-17(20)22-11-13)16-3-1-2-10-21-18(16)24/h4-9,11,16H,1-3,10,12H2,(H,21,24)/t16-/m1/s1