N-[4-[[2-(4-bromanyl-2-methyl-phenoxy)ethanoylcarbamothioylamino]carbamoyl]phenyl]-2-methyl-benzamide

Systemtic Name: N-[4-[[2-(4-bromanyl-2-methyl-phenoxy)ethanoylcarbamothioylamino]carbamoyl]phenyl]-2-methyl-benzamide Openeye Name: N-[4-[[[2-(4-bromo-2-methyl-phenoxy)acetyl]carbamothioylamino]carbamoyl]phenyl]-2-methyl-benzamide CAS Name: N-[4-[[[[[2-(4-bromo-2-methylphenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]-2-methylbenzamide IUPAC Name: N-[4-[[[2-(4-bromo-2-methylphenoxy)acetyl]carbamothioylamino]carbamoyl]phenyl]-2-methylbenzamide Traditional Name: N-[4-[[[2-(4-bromo-2-methyl-phenoxy)acetyl]thiocarbamoylamino]carbamoyl]phenyl]-2-methyl-benzamide Formula: C25H23BrN4O4S MolecularWeight: 555.44352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)COC3=C(C=C(C=C3)Br)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)COC3=C(C=C(C=C3)Br)C

InChI

InChI=1S/C25H23BrN4O4S/c1-15-5-3-4-6-20(15)24(33)27-19-10-7-17(8-11-19)23(32)29-30-25(35)28-22(31)14-34-21-12-9-18(26)13-16(21)2/h3-13H,14H2,1-2H3,(H,27,33)(H,29,32)(H2,28,30,31,35)