7-[2-(4-bromanylphenoxy)ethanoylamino]-N-tert-butyl-3-chloranyl-1-benzothiophene-2-carboxamide

Systemtic Name: 7-[2-(4-bromanylphenoxy)ethanoylamino]-N-tert-butyl-3-chloranyl-1-benzothiophene-2-carboxamide Openeye Name: 7-[[2-(4-bromophenoxy)acetyl]amino]-N-tert-butyl-3-chloro-benzothiophene-2-carboxamide CAS Name: 7-[[2-(4-bromophenoxy)-1-oxoethyl]amino]-N-tert-butyl-3-chloro-1-benzothiophene-2-carboxamide IUPAC Name: 7-[[2-(4-bromophenoxy)acetyl]amino]-N-tert-butyl-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: 7-[[2-(4-bromophenoxy)acetyl]amino]-N-tert-butyl-3-chloro-benzothiophene-2-carboxamide Formula: C21H20BrClN2O3S MolecularWeight: 495.8171

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=C(C2=C(S1)C(=CC=C2)NC(=O)COC3=CC=C(C=C3)Br)Cl

Isomeric SMILES

CC(C)(C)NC(=O)C1=C(C2=C(S1)C(=CC=C2)NC(=O)COC3=CC=C(C=C3)Br)Cl

InChI

InChI=1S/C21H20BrClN2O3S/c1-21(2,3)25-20(27)19-17(23)14-5-4-6-15(18(14)29-19)24-16(26)11-28-13-9-7-12(22)8-10-13/h4-10H,11H2,1-3H3,(H,24,26)(H,25,27)