3-bromanyl-N-[4-(ethanoylcarbamothioylamino)phenyl]-4-ethoxy-benzamide

Systemtic Name: 3-bromanyl-N-[4-(ethanoylcarbamothioylamino)phenyl]-4-ethoxy-benzamide Openeye Name: N-[4-(acetylcarbamothioylamino)phenyl]-3-bromo-4-ethoxy-benzamide CAS Name: N-[4-[[acetamido(sulfanylidene)methyl]amino]phenyl]-3-bromo-4-ethoxybenzamide IUPAC Name: N-[4-(acetylcarbamothioylamino)phenyl]-3-bromo-4-ethoxybenzamide Traditional Name: N-[4-(acetylthiocarbamoylamino)phenyl]-3-bromo-4-ethoxy-benzamide Formula: C18H18BrN3O3S MolecularWeight: 436.32282

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)C)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)C)Br

InChI

InChI=1S/C18H18BrN3O3S/c1-3-25-16-9-4-12(10-15(16)19)17(24)21-13-5-7-14(8-6-13)22-18(26)20-11(2)23/h4-10H,3H2,1-2H3,(H,21,24)(H2,20,22,23,26)