N-[4-[[2-(4-bromanyl-2-chloranyl-phenoxy)ethanoylcarbamothioylamino]carbamoyl]phenyl]propanamide

Systemtic Name: N-[4-[[2-(4-bromanyl-2-chloranyl-phenoxy)ethanoylcarbamothioylamino]carbamoyl]phenyl]propanamide Openeye Name: N-[4-[[[2-(4-bromo-2-chloro-phenoxy)acetyl]carbamothioylamino]carbamoyl]phenyl]propanamide CAS Name: N-[4-[[[[[2-(4-bromo-2-chlorophenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]propanamide IUPAC Name: N-[4-[[[2-(4-bromo-2-chlorophenoxy)acetyl]carbamothioylamino]carbamoyl]phenyl]propanamide Traditional Name: N-[4-[[[2-(4-bromo-2-chloro-phenoxy)acetyl]thiocarbamoylamino]carbamoyl]phenyl]propionamide Formula: C19H18BrClN4O4S MolecularWeight: 513.79262

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)COC2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)COC2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C19H18BrClN4O4S/c1-2-16(26)22-13-6-3-11(4-7-13)18(28)24-25-19(30)23-17(27)10-29-15-8-5-12(20)9-14(15)21/h3-9H,2,10H2,1H3,(H,22,26)(H,24,28)(H2,23,25,27,30)