3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-thiophen-2-ylethyl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-thiophen-2-ylethyl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-[2-(2-thienyl)ethyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-methoxy-N-(2-thiophen-2-ylethyl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-thiophen-2-ylethyl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-[2-(2-thienyl)ethyl]benzamide Formula: C20H26N2O4S2 MolecularWeight: 422.56144

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCCC2=CC=CS2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCCC2=CC=CS2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C20H26N2O4S2/c1-26-18-9-8-16(20(23)21-11-10-17-7-6-14-27-17)15-19(18)28(24,25)22-12-4-2-3-5-13-22/h6-9,14-15H,2-5,10-13H2,1H3,(H,21,23)