2-[2-[2,4-bis(bromanyl)phenoxy]ethanoylcarbamothioylamino]-4,5-dimethyl-thiophene-3-carboxamide

Systemtic Name: 2-[2-[2,4-bis(bromanyl)phenoxy]ethanoylcarbamothioylamino]-4,5-dimethyl-thiophene-3-carboxamide Openeye Name: 2-[[2-(2,4-dibromophenoxy)acetyl]carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxamide CAS Name: 2-[[[[2-(2,4-dibromophenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]-4,5-dimethyl-3-thiophenecarboxamide IUPAC Name: 2-[[2-(2,4-dibromophenoxy)acetyl]carbamothioylamino]-4,5-dimethylthiophene-3-carboxamide Traditional Name: 2-[[2-(2,4-dibromophenoxy)acetyl]thiocarbamoylamino]-4,5-dimethyl-thiophene-3-carboxamide Formula: C16H15Br2N3O3S2 MolecularWeight: 521.2466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)COC2=C(C=C(C=C2)Br)Br)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)COC2=C(C=C(C=C2)Br)Br)C

InChI

InChI=1S/C16H15Br2N3O3S2/c1-7-8(2)26-15(13(7)14(19)23)21-16(25)20-12(22)6-24-11-4-3-9(17)5-10(11)18/h3-5H,6H2,1-2H3,(H2,19,23)(H2,20,21,22,25)