2-[(4-chlorophenyl)-methylsulfonyl-amino]-N-ethyl-butanamide

Systemtic Name: 2-[(4-chlorophenyl)-methylsulfonyl-amino]-N-ethyl-butanamide Openeye Name: 2-(4-chloro-N-methylsulfonyl-anilino)-N-ethyl-butanamide CAS Name: 2-(4-chloro-N-methylsulfonylanilino)-N-ethylbutanamide IUPAC Name: 2-(4-chloro-N-methylsulfonylanilino)-N-ethylbutanamide Traditional Name: 2-(4-chloro-N-mesyl-anilino)-N-ethyl-butyramide Formula: C13H19ClN2O3S MolecularWeight: 318.81956

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC)N(C1=CC=C(C=C1)Cl)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NCC)N(C1=CC=C(C=C1)Cl)S(=O)(=O)C

InChI

InChI=1S/C13H19ClN2O3S/c1-4-12(13(17)15-5-2)16(20(3,18)19)11-8-6-10(14)7-9-11/h6-9,12H,4-5H2,1-3H3,(H,15,17)