4-(azepan-1-ylsulfonyl)-N-(2,4-dimethylphenyl)thiophene-2-carboxamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-(2,4-dimethylphenyl)thiophene-2-carboxamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-(2,4-dimethylphenyl)thiophene-2-carboxamide CAS Name: 4-(1-azepanylsulfonyl)-N-(2,4-dimethylphenyl)-2-thiophenecarboxamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-(2,4-dimethylphenyl)thiophene-2-carboxamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-(2,4-dimethylphenyl)thiophene-2-carboxamide Formula: C19H24N2O3S2 MolecularWeight: 392.53546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=CC(=CS2)S(=O)(=O)N3CCCCCC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=CC(=CS2)S(=O)(=O)N3CCCCCC3)C

InChI

InChI=1S/C19H24N2O3S2/c1-14-7-8-17(15(2)11-14)20-19(22)18-12-16(13-25-18)26(23,24)21-9-5-3-4-6-10-21/h7-8,11-13H,3-6,9-10H2,1-2H3,(H,20,22)