6-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-N-ethyl-N-phenyl-pyridine-3-sulfonamide

Systemtic Name: 6-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-N-ethyl-N-phenyl-pyridine-3-sulfonamide Openeye Name: 6-[4-(azepane-1-carbonyl)-1-piperidyl]-N-ethyl-N-phenyl-pyridine-3-sulfonamide CAS Name: 6-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-N-ethyl-N-phenyl-3-pyridinesulfonamide IUPAC Name: 6-[4-(azepane-1-carbonyl)piperidin-1-yl]-N-ethyl-N-phenylpyridine-3-sulfonamide Traditional Name: 6-[4-(azepane-1-carbonyl)piperidino]-N-ethyl-N-phenyl-pyridine-3-sulfonamide Formula: C25H34N4O3S MolecularWeight: 470.62746

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CN=C(C=C2)N3CCC(CC3)C(=O)N4CCCCCC4

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CN=C(C=C2)N3CCC(CC3)C(=O)N4CCCCCC4

InChI

InChI=1S/C25H34N4O3S/c1-2-29(22-10-6-5-7-11-22)33(31,32)23-12-13-24(26-20-23)27-18-14-21(15-19-27)25(30)28-16-8-3-4-9-17-28/h5-7,10-13,20-21H,2-4,8-9,14-19H2,1H3