2-[4-[2,4-bis(chloranyl)phenoxy]butanoylcarbamothioylamino]-N-cyclohexyl-N-methyl-benzamide

Systemtic Name: 2-[4-[2,4-bis(chloranyl)phenoxy]butanoylcarbamothioylamino]-N-cyclohexyl-N-methyl-benzamide Openeye Name: N-cyclohexyl-2-[4-(2,4-dichlorophenoxy)butanoylcarbamothioylamino]-N-methyl-benzamide CAS Name: N-cyclohexyl-2-[[[[4-(2,4-dichlorophenoxy)-1-oxobutyl]amino]-sulfanylidenemethyl]amino]-N-methylbenzamide IUPAC Name: N-cyclohexyl-2-[4-(2,4-dichlorophenoxy)butanoylcarbamothioylamino]-N-methylbenzamide Traditional Name: N-cyclohexyl-2-[4-(2,4-dichlorophenoxy)butanoylthiocarbamoylamino]-N-methyl-benzamide Formula: C25H29Cl2N3O3S MolecularWeight: 522.48706

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CN(C1CCCCC1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C25H29Cl2N3O3S/c1-30(18-8-3-2-4-9-18)24(32)19-10-5-6-11-21(19)28-25(34)29-23(31)12-7-15-33-22-14-13-17(26)16-20(22)27/h5-6,10-11,13-14,16,18H,2-4,7-9,12,15H2,1H3,(H2,28,29,31,34)