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

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-thiophen-3-yl-ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(3-thienyl)acetamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-2-(3-thiophenyl)acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-2-thiophen-3-ylacetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(3-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=CSC=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CC2=CSC=C2)S(=O)(=O)N3CCCCCC3

InChI

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