N-[4-[[4-[2,4-bis(chloranyl)phenoxy]butanoylcarbamothioylamino]carbamoyl]phenyl]-3-methyl-benzamide

Systemtic Name: N-[4-[[4-[2,4-bis(chloranyl)phenoxy]butanoylcarbamothioylamino]carbamoyl]phenyl]-3-methyl-benzamide Openeye Name: N-[4-[[4-(2,4-dichlorophenoxy)butanoylcarbamothioylamino]carbamoyl]phenyl]-3-methyl-benzamide CAS Name: N-[4-[[[[[4-(2,4-dichlorophenoxy)-1-oxobutyl]amino]-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]-3-methylbenzamide IUPAC Name: N-[4-[[4-(2,4-dichlorophenoxy)butanoylcarbamothioylamino]carbamoyl]phenyl]-3-methylbenzamide Traditional Name: N-[4-[[4-(2,4-dichlorophenoxy)butanoylthiocarbamoylamino]carbamoyl]phenyl]-3-methyl-benzamide Formula: C26H24Cl2N4O4S MolecularWeight: 559.46416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C26H24Cl2N4O4S/c1-16-4-2-5-18(14-16)24(34)29-20-10-7-17(8-11-20)25(35)31-32-26(37)30-23(33)6-3-13-36-22-12-9-19(27)15-21(22)28/h2,4-5,7-12,14-15H,3,6,13H2,1H3,(H,29,34)(H,31,35)(H2,30,32,33,37)