2-[4-[2,4-bis(chloranyl)phenoxy]butanoylcarbamothioylamino]-4-ethyl-5-methyl-thiophene-3-carboxamide

Systemtic Name: 2-[4-[2,4-bis(chloranyl)phenoxy]butanoylcarbamothioylamino]-4-ethyl-5-methyl-thiophene-3-carboxamide Openeye Name: 2-[4-(2,4-dichlorophenoxy)butanoylcarbamothioylamino]-4-ethyl-5-methyl-thiophene-3-carboxamide CAS Name: 2-[[[[4-(2,4-dichlorophenoxy)-1-oxobutyl]amino]-sulfanylidenemethyl]amino]-4-ethyl-5-methyl-3-thiophenecarboxamide IUPAC Name: 2-[4-(2,4-dichlorophenoxy)butanoylcarbamothioylamino]-4-ethyl-5-methylthiophene-3-carboxamide Traditional Name: 2-[4-(2,4-dichlorophenoxy)butanoylthiocarbamoylamino]-4-ethyl-5-methyl-thiophene-3-carboxamide Formula: C19H21Cl2N3O3S2 MolecularWeight: 474.42434

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl)C

InChI

InChI=1S/C19H21Cl2N3O3S2/c1-3-12-10(2)29-18(16(12)17(22)26)24-19(28)23-15(25)5-4-8-27-14-7-6-11(20)9-13(14)21/h6-7,9H,3-5,8H2,1-2H3,(H2,22,26)(H2,23,24,25,28)