N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-thiophen-2-yl-ethanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-thiophen-2-yl-ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(2-thienyl)acetamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-2-thiophen-2-ylacetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-2-thiophen-2-ylacetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(2-thienyl)acetamide Formula: C19H24N2O3S2 MolecularWeight: 392.53546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CC2=CC=CS2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CC2=CC=CS2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C19H24N2O3S2/c1-15-8-9-16(20-19(22)14-17-7-6-12-25-17)13-18(15)26(23,24)21-10-4-2-3-5-11-21/h6-9,12-13H,2-5,10-11,14H2,1H3,(H,20,22)