2-[2-[2,4-bis(bromanyl)-6-methyl-phenoxy]ethanoylamino]-4-methyl-5-(phenylmethyl)thiophene-3-carboxamide

Systemtic Name: 2-[2-[2,4-bis(bromanyl)-6-methyl-phenoxy]ethanoylamino]-4-methyl-5-(phenylmethyl)thiophene-3-carboxamide Openeye Name: 5-benzyl-2-[[2-(2,4-dibromo-6-methyl-phenoxy)acetyl]amino]-4-methyl-thiophene-3-carboxamide CAS Name: 2-[[2-(2,4-dibromo-6-methylphenoxy)-1-oxoethyl]amino]-4-methyl-5-(phenylmethyl)-3-thiophenecarboxamide IUPAC Name: 5-benzyl-2-[[2-(2,4-dibromo-6-methylphenoxy)acetyl]amino]-4-methylthiophene-3-carboxamide Traditional Name: 5-benzyl-2-[[2-(2,4-dibromo-6-methyl-phenoxy)acetyl]amino]-4-methyl-thiophene-3-carboxamide Formula: C22H20Br2N2O3S MolecularWeight: 552.2788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NC2=C(C(=C(S2)CC3=CC=CC=C3)C)C(=O)N)Br)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)NC2=C(C(=C(S2)CC3=CC=CC=C3)C)C(=O)N)Br)Br

InChI

InChI=1S/C22H20Br2N2O3S/c1-12-8-15(23)10-16(24)20(12)29-11-18(27)26-22-19(21(25)28)13(2)17(30-22)9-14-6-4-3-5-7-14/h3-8,10H,9,11H2,1-2H3,(H2,25,28)(H,26,27)