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

Systemtic Name: 2-[2-(4-bromanyl-3-methyl-phenoxy)ethanoylcarbamothioylamino]-4,5-dimethyl-thiophene-3-carboxamide Openeye Name: 2-[[2-(4-bromo-3-methyl-phenoxy)acetyl]carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxamide CAS Name: 2-[[[[2-(4-bromo-3-methylphenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]-4,5-dimethyl-3-thiophenecarboxamide IUPAC Name: 2-[[2-(4-bromo-3-methylphenoxy)acetyl]carbamothioylamino]-4,5-dimethylthiophene-3-carboxamide Traditional Name: 2-[[2-(4-bromo-3-methyl-phenoxy)acetyl]thiocarbamoylamino]-4,5-dimethyl-thiophene-3-carboxamide Formula: C17H18BrN3O3S2 MolecularWeight: 456.37712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NC(=S)NC2=C(C(=C(S2)C)C)C(=O)N)Br

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NC(=S)NC2=C(C(=C(S2)C)C)C(=O)N)Br

InChI

InChI=1S/C17H18BrN3O3S2/c1-8-6-11(4-5-12(8)18)24-7-13(22)20-17(25)21-16-14(15(19)23)9(2)10(3)26-16/h4-6H,7H2,1-3H3,(H2,19,23)(H2,20,21,22,25)