N-(4-butylphenyl)-N-(4-methylphenyl)sulfonyl-pentanamide

Systemtic Name: N-(4-butylphenyl)-N-(4-methylphenyl)sulfonyl-pentanamide Openeye Name: N-(4-butylphenyl)-N-(p-tolylsulfonyl)pentanamide CAS Name: N-(4-butylphenyl)-N-(4-methylphenyl)sulfonylpentanamide IUPAC Name: N-(4-butylphenyl)-N-(4-methylphenyl)sulfonylpentanamide Traditional Name: N-(4-butylphenyl)-N-tosyl-valeramide Formula: C22H29NO3S MolecularWeight: 387.53556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N(C(=O)CCCC)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)N(C(=O)CCCC)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C22H29NO3S/c1-4-6-8-19-12-14-20(15-13-19)23(22(24)9-7-5-2)27(25,26)21-16-10-18(3)11-17-21/h10-17H,4-9H2,1-3H3