N-[(4-bromophenyl)methyl]-6-chloranyl-N-[(3R)-2-oxidanylideneazepan-3-yl]pyridine-3-sulfonamide

Systemtic Name: N-[(4-bromophenyl)methyl]-6-chloranyl-N-[(3R)-2-oxidanylideneazepan-3-yl]pyridine-3-sulfonamide Openeye Name: N-[(4-bromophenyl)methyl]-6-chloro-N-[(3R)-2-oxoazepan-3-yl]pyridine-3-sulfonamide CAS Name: N-[(4-bromophenyl)methyl]-6-chloro-N-[(3R)-2-oxo-3-azepanyl]-3-pyridinesulfonamide IUPAC Name: N-[(4-bromophenyl)methyl]-6-chloro-N-[(3R)-2-oxoazepan-3-yl]pyridine-3-sulfonamide Traditional Name: N-(4-bromobenzyl)-6-chloro-N-[(3R)-2-ketoazepan-3-yl]pyridine-3-sulfonamide Formula: C18H19BrClN3O3S MolecularWeight: 472.78376

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19BrClN3O3S/c19-14-6-4-13(5-7-14)12-23(16-3-1-2-10-21-18(16)24)27(25,26)15-8-9-17(20)22-11-15/h4-9,11,16H,1-3,10,12H2,(H,21,24)/t16-/m1/s1