N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-ethyl]pentanamide

Systemtic Name: N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-ethyl]pentanamide Openeye Name: N-[2-(p-tolylsulfonyl)-2-(2-thienyl)ethyl]pentanamide CAS Name: N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]pentanamide IUPAC Name: N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]pentanamide Traditional Name: N-[2-(2-thienyl)-2-tosyl-ethyl]valeramide Formula: C18H23NO3S2 MolecularWeight: 365.51012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NCC(C1=CC=CS1)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCC(=O)NCC(C1=CC=CS1)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C18H23NO3S2/c1-3-4-7-18(20)19-13-17(16-6-5-12-23-16)24(21,22)15-10-8-14(2)9-11-15/h5-6,8-12,17H,3-4,7,13H2,1-2H3,(H,19,20)