2-[4-[(4-fluorophenyl)-methylsulfonyl-amino]butanoylamino]-N-propan-2-yl-benzamide

Systemtic Name: 2-[4-[(4-fluorophenyl)-methylsulfonyl-amino]butanoylamino]-N-propan-2-yl-benzamide Openeye Name: 2-[4-(4-fluoro-N-methylsulfonyl-anilino)butanoylamino]-N-isopropyl-benzamide CAS Name: 2-[[4-(4-fluoro-N-methylsulfonylanilino)-1-oxobutyl]amino]-N-propan-2-ylbenzamide IUPAC Name: 2-[4-(4-fluoro-N-methylsulfonylanilino)butanoylamino]-N-propan-2-ylbenzamide Traditional Name: 2-[4-(4-fluoro-N-mesyl-anilino)butanoylamino]-N-isopropyl-benzamide Formula: C21H26FN3O4S MolecularWeight: 435.512243

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC=CC=C1NC(=O)CCCN(C2=CC=C(C=C2)F)S(=O)(=O)C

Isomeric SMILES

CC(C)NC(=O)C1=CC=CC=C1NC(=O)CCCN(C2=CC=C(C=C2)F)S(=O)(=O)C

InChI

InChI=1S/C21H26FN3O4S/c1-15(2)23-21(27)18-7-4-5-8-19(18)24-20(26)9-6-14-25(30(3,28)29)17-12-10-16(22)11-13-17/h4-5,7-8,10-13,15H,6,9,14H2,1-3H3,(H,23,27)(H,24,26)