2-(4-bromanyl-2-methyl-phenoxy)-N-[[(2-methylfuran-3-yl)carbonylamino]carbamothioyl]ethanamide

Systemtic Name: 2-(4-bromanyl-2-methyl-phenoxy)-N-[[(2-methylfuran-3-yl)carbonylamino]carbamothioyl]ethanamide Openeye Name: 2-(4-bromo-2-methyl-phenoxy)-N-[[(2-methylfuran-3-carbonyl)amino]carbamothioyl]acetamide CAS Name: 2-(4-bromo-2-methylphenoxy)-N-[[[(2-methyl-3-furanyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromo-2-methylphenoxy)-N-[[(2-methylfuran-3-carbonyl)amino]carbamothioyl]acetamide Traditional Name: 2-(4-bromo-2-methyl-phenoxy)-N-[[(2-methyl-3-furoyl)amino]thiocarbamoyl]acetamide Formula: C16H16BrN3O4S MolecularWeight: 426.28494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16BrN3O4S/c1-9-7-11(17)3-4-13(9)24-8-14(21)18-16(25)20-19-15(22)12-5-6-23-10(12)2/h3-7H,8H2,1-2H3,(H,19,22)(H2,18,20,21,25)