N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-thiophen-3-yl-ethanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-thiophen-3-yl-ethanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(3-thienyl)acetamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-2-(3-thiophenyl)acetamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-2-thiophen-3-ylacetamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(3-thienyl)acetamide Formula: C19H24N2O4S2 MolecularWeight: 408.53486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)CC3=CSC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)CC3=CSC=C3

InChI

InChI=1S/C19H24N2O4S2/c1-25-18-7-6-16(27(23,24)21-9-4-2-3-5-10-21)13-17(18)20-19(22)12-15-8-11-26-14-15/h6-8,11,13-14H,2-5,9-10,12H2,1H3,(H,20,22)