2-[2-[(3-chlorophenyl)-methylsulfonyl-amino]butanoylamino]-N,N-diethyl-benzamide

Systemtic Name: 2-[2-[(3-chlorophenyl)-methylsulfonyl-amino]butanoylamino]-N,N-diethyl-benzamide Openeye Name: 2-[2-(3-chloro-N-methylsulfonyl-anilino)butanoylamino]-N,N-diethyl-benzamide CAS Name: 2-[[2-(3-chloro-N-methylsulfonylanilino)-1-oxobutyl]amino]-N,N-diethylbenzamide IUPAC Name: 2-[2-(3-chloro-N-methylsulfonylanilino)butanoylamino]-N,N-diethylbenzamide Traditional Name: 2-[2-(3-chloro-N-mesyl-anilino)butanoylamino]-N,N-diethyl-benzamide Formula: C22H28ClN3O4S MolecularWeight: 465.99342

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C(=O)N(CC)CC)N(C2=CC(=CC=C2)Cl)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C(=O)N(CC)CC)N(C2=CC(=CC=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C22H28ClN3O4S/c1-5-20(26(31(4,29)30)17-12-10-11-16(23)15-17)21(27)24-19-14-9-8-13-18(19)22(28)25(6-2)7-3/h8-15,20H,5-7H2,1-4H3,(H,24,27)