N-(3-methylbutyl)-2-[(4-methylphenyl)-methylsulfonyl-amino]butanamide

Systemtic Name: N-(3-methylbutyl)-2-[(4-methylphenyl)-methylsulfonyl-amino]butanamide Openeye Name: N-isopentyl-2-(4-methyl-N-methylsulfonyl-anilino)butanamide CAS Name: N-(3-methylbutyl)-2-(4-methyl-N-methylsulfonylanilino)butanamide IUPAC Name: N-(3-methylbutyl)-2-(4-methyl-N-methylsulfonylanilino)butanamide Traditional Name: N-isoamyl-2-(N-mesyl-4-methyl-anilino)butyramide Formula: C17H28N2O3S MolecularWeight: 340.48082

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCCC(C)C)N(C1=CC=C(C=C1)C)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NCCC(C)C)N(C1=CC=C(C=C1)C)S(=O)(=O)C

InChI

InChI=1S/C17H28N2O3S/c1-6-16(17(20)18-12-11-13(2)3)19(23(5,21)22)15-9-7-14(4)8-10-15/h7-10,13,16H,6,11-12H2,1-5H3,(H,18,20)