4-[4-(5-bromanylthiophen-2-yl)butanoylamino]-N-methyl-benzamide

Systemtic Name: 4-[4-(5-bromanylthiophen-2-yl)butanoylamino]-N-methyl-benzamide Openeye Name: 4-[4-(5-bromo-2-thienyl)butanoylamino]-N-methyl-benzamide CAS Name: 4-[[4-(5-bromo-2-thiophenyl)-1-oxobutyl]amino]-N-methylbenzamide IUPAC Name: 4-[4-(5-bromothiophen-2-yl)butanoylamino]-N-methylbenzamide Traditional Name: 4-[4-(5-bromo-2-thienyl)butanoylamino]-N-methyl-benzamide Formula: C16H17BrN2O2S MolecularWeight: 381.28738

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)NC(=O)CCCC2=CC=C(S2)Br

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)NC(=O)CCCC2=CC=C(S2)Br

InChI

InChI=1S/C16H17BrN2O2S/c1-18-16(21)11-5-7-12(8-6-11)19-15(20)4-2-3-13-9-10-14(17)22-13/h5-10H,2-4H2,1H3,(H,18,21)(H,19,20)