2-[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanyl-N-cyclohexyl-ethanamide

Systemtic Name: 2-[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanyl-N-cyclohexyl-ethanamide Openeye Name: 2-[[5-(azepan-1-ylsulfonyl)-2-pyridyl]sulfanyl]-N-cyclohexyl-acetamide CAS Name: 2-[[5-(1-azepanylsulfonyl)-2-pyridinyl]thio]-N-cyclohexylacetamide IUPAC Name: 2-[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanyl-N-cyclohexylacetamide Traditional Name: 2-[[5-(azepan-1-ylsulfonyl)-2-pyridyl]thio]-N-cyclohexyl-acetamide Formula: C19H29N3O3S2 MolecularWeight: 411.58186

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)NC3CCCCC3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)NC3CCCCC3

InChI

InChI=1S/C19H29N3O3S2/c23-18(21-16-8-4-3-5-9-16)15-26-19-11-10-17(14-20-19)27(24,25)22-12-6-1-2-7-13-22/h10-11,14,16H,1-9,12-13,15H2,(H,21,23)