5-bromanyl-N-[[4-(ethanoylcarbamothioylamino)phenyl]carbamothioyl]-2-methoxy-benzamide

Systemtic Name: 5-bromanyl-N-[[4-(ethanoylcarbamothioylamino)phenyl]carbamothioyl]-2-methoxy-benzamide Openeye Name: N-[[4-(acetylcarbamothioylamino)phenyl]carbamothioyl]-5-bromo-2-methoxy-benzamide CAS Name: N-[[4-[[acetamido(sulfanylidene)methyl]amino]anilino]-sulfanylidenemethyl]-5-bromo-2-methoxybenzamide IUPAC Name: N-[[4-(acetylcarbamothioylamino)phenyl]carbamothioyl]-5-bromo-2-methoxybenzamide Traditional Name: N-[[4-(acetylthiocarbamoylamino)phenyl]thiocarbamoyl]-5-bromo-2-methoxy-benzamide Formula: C18H17BrN4O3S2 MolecularWeight: 481.38658

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(=S)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OC

Isomeric SMILES

CC(=O)NC(=S)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C18H17BrN4O3S2/c1-10(24)20-17(27)21-12-4-6-13(7-5-12)22-18(28)23-16(25)14-9-11(19)3-8-15(14)26-2/h3-9H,1-2H3,(H2,20,21,24,27)(H2,22,23,25,28)