N-[2-(azepan-1-yl)phenyl]-5-[2-(methylsulfonylamino)ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)phenyl]-5-[2-(methylsulfonylamino)ethyl]thiophene-2-carboxamide Openeye Name: N-[2-(azepan-1-yl)phenyl]-5-[2-(methanesulfonamido)ethyl]thiophene-2-carboxamide CAS Name: N-[2-(1-azepanyl)phenyl]-5-[2-(methanesulfonamido)ethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-(azepan-1-yl)phenyl]-5-[2-(methanesulfonamido)ethyl]thiophene-2-carboxamide Traditional Name: N-[2-(azepan-1-yl)phenyl]-5-[2-(methanesulfonamido)ethyl]thiophene-2-carboxamide Formula: C20H27N3O3S2 MolecularWeight: 421.57668

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCCC1=CC=C(S1)C(=O)NC2=CC=CC=C2N3CCCCCC3

Isomeric SMILES

CS(=O)(=O)NCCC1=CC=C(S1)C(=O)NC2=CC=CC=C2N3CCCCCC3

InChI

InChI=1S/C20H27N3O3S2/c1-28(25,26)21-13-12-16-10-11-19(27-16)20(24)22-17-8-4-5-9-18(17)23-14-6-2-3-7-15-23/h4-5,8-11,21H,2-3,6-7,12-15H2,1H3,(H,22,24)