N-[3-[4-(3-bromanylphenoxy)butanoylamino]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[4-(3-bromanylphenoxy)butanoylamino]phenyl]thiophene-2-carboxamide Openeye Name: N-[3-[4-(3-bromophenoxy)butanoylamino]phenyl]thiophene-2-carboxamide CAS Name: N-[3-[[4-(3-bromophenoxy)-1-oxobutyl]amino]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[4-(3-bromophenoxy)butanoylamino]phenyl]thiophene-2-carboxamide Traditional Name: N-[3-[4-(3-bromophenoxy)butanoylamino]phenyl]thiophene-2-carboxamide Formula: C21H19BrN2O3S MolecularWeight: 459.35616

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CCCOC2=CC(=CC=C2)Br)NC(=O)C3=CC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CCCOC2=CC(=CC=C2)Br)NC(=O)C3=CC=CS3

InChI

InChI=1S/C21H19BrN2O3S/c22-15-5-1-8-18(13-15)27-11-3-10-20(25)23-16-6-2-7-17(14-16)24-21(26)19-9-4-12-28-19/h1-2,4-9,12-14H,3,10-11H2,(H,23,25)(H,24,26)