N-[2-(azepan-1-ylcarbonyl)-1-benzothiophen-5-yl]-N-ethyl-4-methyl-benzenesulfonamide

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)-1-benzothiophen-5-yl]-N-ethyl-4-methyl-benzenesulfonamide Openeye Name: N-[2-(azepane-1-carbonyl)benzothiophen-5-yl]-N-ethyl-4-methyl-benzenesulfonamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]-1-benzothiophen-5-yl]-N-ethyl-4-methylbenzenesulfonamide IUPAC Name: N-[2-(azepane-1-carbonyl)-1-benzothiophen-5-yl]-N-ethyl-4-methylbenzenesulfonamide Traditional Name: N-[2-(azepane-1-carbonyl)benzothiophen-5-yl]-N-ethyl-4-methyl-benzenesulfonamide Formula: C24H28N2O3S2 MolecularWeight: 456.62072

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC2=C(C=C1)SC(=C2)C(=O)N3CCCCCC3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCN(C1=CC2=C(C=C1)SC(=C2)C(=O)N3CCCCCC3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C24H28N2O3S2/c1-3-26(31(28,29)21-11-8-18(2)9-12-21)20-10-13-22-19(16-20)17-23(30-22)24(27)25-14-6-4-5-7-15-25/h8-13,16-17H,3-7,14-15H2,1-2H3