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

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-(5-chloranyl-2-oxidanyl-phenyl)thiophene-2-carboxamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-(5-chloro-2-hydroxy-phenyl)thiophene-2-carboxamide CAS Name: 4-(1-azepanylsulfonyl)-N-(5-chloro-2-hydroxyphenyl)-2-thiophenecarboxamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-(5-chloro-2-hydroxyphenyl)thiophene-2-carboxamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-(5-chloro-2-hydroxy-phenyl)thiophene-2-carboxamide Formula: C17H19ClN2O4S2 MolecularWeight: 414.92676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CSC(=C2)C(=O)NC3=C(C=CC(=C3)Cl)O

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CSC(=C2)C(=O)NC3=C(C=CC(=C3)Cl)O

InChI

InChI=1S/C17H19ClN2O4S2/c18-12-5-6-15(21)14(9-12)19-17(22)16-10-13(11-25-16)26(23,24)20-7-3-1-2-4-8-20/h5-6,9-11,21H,1-4,7-8H2,(H,19,22)