N-[4-(azepan-1-ylsulfonyl)phenyl]-2,5-bis(chloranyl)thiophene-3-sulfonamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2,5-bis(chloranyl)thiophene-3-sulfonamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2,5-dichloro-thiophene-3-sulfonamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-2,5-dichloro-3-thiophenesulfonamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2,5-dichlorothiophene-3-sulfonamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2,5-dichloro-thiophene-3-sulfonamide Formula: C16H18Cl2N2O4S3 MolecularWeight: 469.42612

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=C(SC(=C3)Cl)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=C(SC(=C3)Cl)Cl

InChI

InChI=1S/C16H18Cl2N2O4S3/c17-15-11-14(16(18)25-15)26(21,22)19-12-5-7-13(8-6-12)27(23,24)20-9-3-1-2-4-10-20/h5-8,11,19H,1-4,9-10H2