N-ethyl-1-[2-(6-methylpyridin-2-yl)ethylamino]-2-oxidanylidene-1-phenyl-pentane-1-sulfonamide

Systemtic Name: N-ethyl-1-[2-(6-methylpyridin-2-yl)ethylamino]-2-oxidanylidene-1-phenyl-pentane-1-sulfonamide Openeye Name: N-ethyl-1-[2-(6-methyl-2-pyridyl)ethylamino]-2-oxo-1-phenyl-pentane-1-sulfonamide CAS Name: N-ethyl-1-[2-(6-methyl-2-pyridinyl)ethylamino]-2-oxo-1-phenyl-1-pentanesulfonamide IUPAC Name: N-ethyl-1-[2-(6-methylpyridin-2-yl)ethylamino]-2-oxo-1-phenylpentane-1-sulfonamide Traditional Name: N-ethyl-2-keto-1-[2-(6-methyl-2-pyridyl)ethylamino]-1-phenyl-pentane-1-sulfonamide Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C(C1=CC=CC=C1)(NCCC2=CC=CC(=N2)C)S(=O)(=O)NCC

Isomeric SMILES

CCCC(=O)C(C1=CC=CC=C1)(NCCC2=CC=CC(=N2)C)S(=O)(=O)NCC

InChI

InChI=1S/C21H29N3O3S/c1-4-10-20(25)21(28(26,27)23-5-2,18-12-7-6-8-13-18)22-16-15-19-14-9-11-17(3)24-19/h6-9,11-14,22-23H,4-5,10,15-16H2,1-3H3