2-(4-bromanyl-2-methyl-phenoxy)-N-[(phenylcarbamothioylamino)carbamothioyl]ethanamide

Systemtic Name: 2-(4-bromanyl-2-methyl-phenoxy)-N-[(phenylcarbamothioylamino)carbamothioyl]ethanamide Openeye Name: 2-(4-bromo-2-methyl-phenoxy)-N-[(phenylcarbamothioylamino)carbamothioyl]acetamide CAS Name: N-[[[anilino(sulfanylidene)methyl]hydrazo]-sulfanylidenemethyl]-2-(4-bromo-2-methylphenoxy)acetamide IUPAC Name: 2-(4-bromo-2-methylphenoxy)-N-[(phenylcarbamothioylamino)carbamothioyl]acetamide Traditional Name: 2-(4-bromo-2-methyl-phenoxy)-N-[(phenylthiocarbamoylamino)thiocarbamoyl]acetamide Formula: C17H17BrN4O2S2 MolecularWeight: 453.37648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)OCC(=O)NC(=S)NNC(=S)NC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=CC(=C1)Br)OCC(=O)NC(=S)NNC(=S)NC2=CC=CC=C2

InChI

InChI=1S/C17H17BrN4O2S2/c1-11-9-12(18)7-8-14(11)24-10-15(23)20-17(26)22-21-16(25)19-13-5-3-2-4-6-13/h2-9H,10H2,1H3,(H2,19,21,25)(H2,20,22,23,26)