3-bromanyl-4-methyl-N-[[2-(4-propan-2-ylphenoxy)ethanoylamino]carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-methyl-N-[[2-(4-propan-2-ylphenoxy)ethanoylamino]carbamothioyl]benzamide Openeye Name: 3-bromo-N-[[[2-(4-isopropylphenoxy)acetyl]amino]carbamothioyl]-4-methyl-benzamide CAS Name: 3-bromo-4-methyl-N-[[[1-oxo-2-(4-propan-2-ylphenoxy)ethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-methyl-N-[[[2-(4-propan-2-ylphenoxy)acetyl]amino]carbamothioyl]benzamide Traditional Name: 3-bromo-N-[[[2-(4-isopropylphenoxy)acetyl]amino]thiocarbamoyl]-4-methyl-benzamide Formula: C20H22BrN3O3S MolecularWeight: 464.37598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)C(C)C)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)COC2=CC=C(C=C2)C(C)C)Br

InChI

InChI=1S/C20H22BrN3O3S/c1-12(2)14-6-8-16(9-7-14)27-11-18(25)23-24-20(28)22-19(26)15-5-4-13(3)17(21)10-15/h4-10,12H,11H2,1-3H3,(H,23,25)(H2,22,24,26,28)