N-[(4-bromophenyl)methyl]-5-chloranyl-N-[(3R)-2-oxidanylideneazepan-3-yl]thiophene-2-sulfonamide

Systemtic Name: N-[(4-bromophenyl)methyl]-5-chloranyl-N-[(3R)-2-oxidanylideneazepan-3-yl]thiophene-2-sulfonamide Openeye Name: N-[(4-bromophenyl)methyl]-5-chloro-N-[(3R)-2-oxoazepan-3-yl]thiophene-2-sulfonamide CAS Name: N-[(4-bromophenyl)methyl]-5-chloro-N-[(3R)-2-oxo-3-azepanyl]-2-thiophenesulfonamide IUPAC Name: N-[(4-bromophenyl)methyl]-5-chloro-N-[(3R)-2-oxoazepan-3-yl]thiophene-2-sulfonamide Traditional Name: N-(4-bromobenzyl)-5-chloro-N-[(3R)-2-ketoazepan-3-yl]thiophene-2-sulfonamide Formula: C17H18BrClN2O3S2 MolecularWeight: 477.82342

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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=CC=C(S3)Cl

Isomeric SMILES

C1CCNC(=O)[C@@H](C1)N(CC2=CC=C(C=C2)Br)S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C17H18BrClN2O3S2/c18-13-6-4-12(5-7-13)11-21(14-3-1-2-10-20-17(14)22)26(23,24)16-9-8-15(19)25-16/h4-9,14H,1-3,10-11H2,(H,20,22)/t14-/m1/s1