N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]thiophene-2-sulfonamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]thiophene-2-sulfonamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]thiophene-2-sulfonamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-2-thiophenesulfonamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]thiophene-2-sulfonamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]thiophene-2-sulfonamide Formula: C17H22N2O5S3 MolecularWeight: 430.56198

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C17H22N2O5S3/c1-24-16-9-8-14(27(22,23)19-10-4-2-3-5-11-19)13-15(16)18-26(20,21)17-7-6-12-25-17/h6-9,12-13,18H,2-5,10-11H2,1H3