N-[4-(azepan-1-ylsulfonyl)phenyl]-2-cyclopentylsulfanyl-ethanamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-cyclopentylsulfanyl-ethanamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-cyclopentylsulfanyl-acetamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-2-(cyclopentylthio)acetamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-cyclopentylsulfanylacetamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(cyclopentylthio)acetamide Formula: C19H28N2O3S2 MolecularWeight: 396.56722

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3CCCC3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3CCCC3

InChI

InChI=1S/C19H28N2O3S2/c22-19(15-25-17-7-3-4-8-17)20-16-9-11-18(12-10-16)26(23,24)21-13-5-1-2-6-14-21/h9-12,17H,1-8,13-15H2,(H,20,22)