4-[(3-chlorophenyl)-methylsulfonyl-amino]-N-ethyl-butanamide

Systemtic Name: 4-[(3-chlorophenyl)-methylsulfonyl-amino]-N-ethyl-butanamide Openeye Name: 4-(3-chloro-N-methylsulfonyl-anilino)-N-ethyl-butanamide CAS Name: 4-(3-chloro-N-methylsulfonylanilino)-N-ethylbutanamide IUPAC Name: 4-(3-chloro-N-methylsulfonylanilino)-N-ethylbutanamide Traditional Name: 4-(3-chloro-N-mesyl-anilino)-N-ethyl-butyramide Formula: C13H19ClN2O3S MolecularWeight: 318.81956

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)CCCN(C1=CC(=CC=C1)Cl)S(=O)(=O)C

Isomeric SMILES

CCNC(=O)CCCN(C1=CC(=CC=C1)Cl)S(=O)(=O)C

InChI

InChI=1S/C13H19ClN2O3S/c1-3-15-13(17)8-5-9-16(20(2,18)19)12-7-4-6-11(14)10-12/h4,6-7,10H,3,5,8-9H2,1-2H3,(H,15,17)