3-bromanyl-4-butoxy-N-(thiophen-2-ylmethylcarbamothioyl)benzamide

Systemtic Name: 3-bromanyl-4-butoxy-N-(thiophen-2-ylmethylcarbamothioyl)benzamide Openeye Name: 3-bromo-4-butoxy-N-(2-thienylmethylcarbamothioyl)benzamide CAS Name: 3-bromo-4-butoxy-N-[sulfanylidene-(thiophen-2-ylmethylamino)methyl]benzamide IUPAC Name: 3-bromo-4-butoxy-N-(thiophen-2-ylmethylcarbamothioyl)benzamide Traditional Name: 3-bromo-4-butoxy-N-(2-thenylthiocarbamoyl)benzamide Formula: C17H19BrN2O2S2 MolecularWeight: 427.37896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NCC2=CC=CS2)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NCC2=CC=CS2)Br

InChI

InChI=1S/C17H19BrN2O2S2/c1-2-3-8-22-15-7-6-12(10-14(15)18)16(21)20-17(23)19-11-13-5-4-9-24-13/h4-7,9-10H,2-3,8,11H2,1H3,(H2,19,20,21,23)