N-[2-(4-methylphenyl)sulfonyl-2-pyridin-3-yl-ethyl]butane-1-sulfonamide

Systemtic Name: N-[2-(4-methylphenyl)sulfonyl-2-pyridin-3-yl-ethyl]butane-1-sulfonamide Openeye Name: N-[2-(p-tolylsulfonyl)-2-(3-pyridyl)ethyl]butane-1-sulfonamide CAS Name: N-[2-(4-methylphenyl)sulfonyl-2-(3-pyridinyl)ethyl]-1-butanesulfonamide IUPAC Name: N-[2-(4-methylphenyl)sulfonyl-2-pyridin-3-ylethyl]butane-1-sulfonamide Traditional Name: N-[2-(3-pyridyl)-2-tosyl-ethyl]butane-1-sulfonamide Formula: C18H24N2O4S2 MolecularWeight: 396.52416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NCC(C1=CN=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCS(=O)(=O)NCC(C1=CN=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C18H24N2O4S2/c1-3-4-12-25(21,22)20-14-18(16-6-5-11-19-13-16)26(23,24)17-9-7-15(2)8-10-17/h5-11,13,18,20H,3-4,12,14H2,1-2H3