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

Systemtic Name: N-[2-[4-(5-bromanylthiophen-2-yl)butanoylamino]ethyl]benzamide Openeye Name: N-[2-[4-(5-bromo-2-thienyl)butanoylamino]ethyl]benzamide CAS Name: N-[2-[[4-(5-bromo-2-thiophenyl)-1-oxobutyl]amino]ethyl]benzamide IUPAC Name: N-[2-[4-(5-bromothiophen-2-yl)butanoylamino]ethyl]benzamide Traditional Name: N-[2-[4-(5-bromo-2-thienyl)butanoylamino]ethyl]benzamide Formula: C17H19BrN2O2S MolecularWeight: 395.31396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NCCNC(=O)CCCC2=CC=C(S2)Br

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NCCNC(=O)CCCC2=CC=C(S2)Br

InChI

InChI=1S/C17H19BrN2O2S/c18-15-10-9-14(23-15)7-4-8-16(21)19-11-12-20-17(22)13-5-2-1-3-6-13/h1-3,5-6,9-10H,4,7-8,11-12H2,(H,19,21)(H,20,22)