4-(azepan-1-ylsulfonyl)-N-(5-methyl-2-oxidanyl-phenyl)thiophene-2-carboxamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-(5-methyl-2-oxidanyl-phenyl)thiophene-2-carboxamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-(2-hydroxy-5-methyl-phenyl)thiophene-2-carboxamide CAS Name: 4-(1-azepanylsulfonyl)-N-(2-hydroxy-5-methylphenyl)-2-thiophenecarboxamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-(2-hydroxy-5-methylphenyl)thiophene-2-carboxamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-(2-hydroxy-5-methyl-phenyl)thiophene-2-carboxamide Formula: C18H22N2O4S2 MolecularWeight: 394.50828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O4S2/c1-13-6-7-16(21)15(10-13)19-18(22)17-11-14(12-25-17)26(23,24)20-8-4-2-3-5-9-20/h6-7,10-12,21H,2-5,8-9H2,1H3,(H,19,22)