N-[[6-(azepan-1-yl)pyridin-3-yl]methyl]-2-methylsulfonyl-propanamide

Systemtic Name: N-[[6-(azepan-1-yl)pyridin-3-yl]methyl]-2-methylsulfonyl-propanamide Openeye Name: N-[[6-(azepan-1-yl)-3-pyridyl]methyl]-2-methylsulfonyl-propanamide CAS Name: N-[[6-(1-azepanyl)-3-pyridinyl]methyl]-2-methylsulfonylpropanamide IUPAC Name: N-[[6-(azepan-1-yl)pyridin-3-yl]methyl]-2-methylsulfonylpropanamide Traditional Name: N-[[6-(azepan-1-yl)-3-pyridyl]methyl]-2-mesyl-propionamide Formula: C16H25N3O3S MolecularWeight: 339.453

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CN=C(C=C1)N2CCCCCC2)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)NCC1=CN=C(C=C1)N2CCCCCC2)S(=O)(=O)C

InChI

InChI=1S/C16H25N3O3S/c1-13(23(2,21)22)16(20)18-12-14-7-8-15(17-11-14)19-9-5-3-4-6-10-19/h7-8,11,13H,3-6,9-10,12H2,1-2H3,(H,18,20)