N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[(5-chloranylthiophen-2-yl)methyl-methyl-amino]ethanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[(5-chloranylthiophen-2-yl)methyl-methyl-amino]ethanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[(5-chloro-2-thienyl)methyl-methyl-amino]acetamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-2-[(5-chloro-2-thiophenyl)methyl-methylamino]acetamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-2-[(5-chlorothiophen-2-yl)methyl-methylamino]acetamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[(5-chloro-2-thienyl)methyl-methyl-amino]acetamide Formula: C21H28ClN3O4S2 MolecularWeight: 486.04772

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(S1)Cl)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

Isomeric SMILES

CN(CC1=CC=C(S1)Cl)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

InChI

InChI=1S/C21H28ClN3O4S2/c1-24(14-16-7-10-20(22)30-16)15-21(26)23-18-13-17(8-9-19(18)29-2)31(27,28)25-11-5-3-4-6-12-25/h7-10,13H,3-6,11-12,14-15H2,1-2H3,(H,23,26)