N-[[4-[2,4-bis(chloranyl)phenoxy]butanoylamino]carbamothioyl]-3-bromanyl-4-propoxy-benzamide

Systemtic Name: N-[[4-[2,4-bis(chloranyl)phenoxy]butanoylamino]carbamothioyl]-3-bromanyl-4-propoxy-benzamide Openeye Name: 3-bromo-N-[[4-(2,4-dichlorophenoxy)butanoylamino]carbamothioyl]-4-propoxy-benzamide CAS Name: 3-bromo-N-[[[4-(2,4-dichlorophenoxy)-1-oxobutyl]hydrazo]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: 3-bromo-N-[[4-(2,4-dichlorophenoxy)butanoylamino]carbamothioyl]-4-propoxybenzamide Traditional Name: 3-bromo-N-[[4-(2,4-dichlorophenoxy)butanoylamino]thiocarbamoyl]-4-propoxy-benzamide Formula: C21H22BrCl2N3O4S MolecularWeight: 563.29208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl)Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl)Br

InChI

InChI=1S/C21H22BrCl2N3O4S/c1-2-9-30-17-7-5-13(11-15(17)22)20(29)25-21(32)27-26-19(28)4-3-10-31-18-8-6-14(23)12-16(18)24/h5-8,11-12H,2-4,9-10H2,1H3,(H,26,28)(H2,25,27,29,32)