2-[(4-methylphenyl)-methylsulfonyl-amino]-N-pentyl-butanamide

Systemtic Name: 2-[(4-methylphenyl)-methylsulfonyl-amino]-N-pentyl-butanamide Openeye Name: 2-(4-methyl-N-methylsulfonyl-anilino)-N-pentyl-butanamide CAS Name: 2-(4-methyl-N-methylsulfonylanilino)-N-pentylbutanamide IUPAC Name: 2-(4-methyl-N-methylsulfonylanilino)-N-pentylbutanamide Traditional Name: N-amyl-2-(N-mesyl-4-methyl-anilino)butyramide Formula: C17H28N2O3S MolecularWeight: 340.48082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C(CC)N(C1=CC=C(C=C1)C)S(=O)(=O)C

Isomeric SMILES

CCCCCNC(=O)C(CC)N(C1=CC=C(C=C1)C)S(=O)(=O)C

InChI

InChI=1S/C17H28N2O3S/c1-5-7-8-13-18-17(20)16(6-2)19(23(4,21)22)15-11-9-14(3)10-12-15/h9-12,16H,5-8,13H2,1-4H3,(H,18,20)