N-[5-(azepan-1-ylsulfonyl)-2-chloranyl-phenyl]-2-[methyl(thiophen-3-ylmethyl)amino]ethanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-chloranyl-phenyl]-2-[methyl(thiophen-3-ylmethyl)amino]ethanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-chloro-phenyl]-2-[methyl(3-thienylmethyl)amino]acetamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-chlorophenyl]-2-[methyl(3-thiophenylmethyl)amino]acetamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-chlorophenyl]-2-[methyl(thiophen-3-ylmethyl)amino]acetamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-chloro-phenyl]-2-[methyl(3-thenyl)amino]acetamide Formula: C20H26ClN3O3S2 MolecularWeight: 456.02174

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CSC=C1)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)Cl

Isomeric SMILES

CN(CC1=CSC=C1)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)Cl

InChI

InChI=1S/C20H26ClN3O3S2/c1-23(13-16-8-11-28-15-16)14-20(25)22-19-12-17(6-7-18(19)21)29(26,27)24-9-4-2-3-5-10-24/h6-8,11-12,15H,2-5,9-10,13-14H2,1H3,(H,22,25)