N-butan-2-yl-2-[2-[(4-chlorophenyl)-methylsulfonyl-amino]propanoylamino]benzamide

Systemtic Name: N-butan-2-yl-2-[2-[(4-chlorophenyl)-methylsulfonyl-amino]propanoylamino]benzamide Openeye Name: 2-[2-(4-chloro-N-methylsulfonyl-anilino)propanoylamino]-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-2-[[2-(4-chloro-N-methylsulfonylanilino)-1-oxopropyl]amino]benzamide IUPAC Name: N-butan-2-yl-2-[2-(4-chloro-N-methylsulfonylanilino)propanoylamino]benzamide Traditional Name: 2-[2-(4-chloro-N-mesyl-anilino)propanoylamino]-N-sec-butyl-benzamide Formula: C21H26ClN3O4S MolecularWeight: 451.96684

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC=CC=C1NC(=O)C(C)N(C2=CC=C(C=C2)Cl)S(=O)(=O)C

Isomeric SMILES

CCC(C)NC(=O)C1=CC=CC=C1NC(=O)C(C)N(C2=CC=C(C=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C21H26ClN3O4S/c1-5-14(2)23-21(27)18-8-6-7-9-19(18)24-20(26)15(3)25(30(4,28)29)17-12-10-16(22)11-13-17/h6-15H,5H2,1-4H3,(H,23,27)(H,24,26)