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

Systemtic Name: N-[4-[[2-(2-bromanyl-4-methyl-phenoxy)ethanoylcarbamothioylamino]carbamoyl]phenyl]-2-methyl-benzamide Openeye Name: N-[4-[[[2-(2-bromo-4-methyl-phenoxy)acetyl]carbamothioylamino]carbamoyl]phenyl]-2-methyl-benzamide CAS Name: N-[4-[[[[[2-(2-bromo-4-methylphenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]-2-methylbenzamide IUPAC Name: N-[4-[[[2-(2-bromo-4-methylphenoxy)acetyl]carbamothioylamino]carbamoyl]phenyl]-2-methylbenzamide Traditional Name: N-[4-[[[2-(2-bromo-4-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(=C(C=C1)OCC(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3C)Br

InChI

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