2-[2-[1,6-bis(bromanyl)naphthalen-2-yl]oxyethanoylcarbamothioylamino]-4-methyl-5-(phenylmethyl)thiophene-3-carboxamide

Systemtic Name: 2-[2-[1,6-bis(bromanyl)naphthalen-2-yl]oxyethanoylcarbamothioylamino]-4-methyl-5-(phenylmethyl)thiophene-3-carboxamide Openeye Name: 5-benzyl-2-[[2-[(1,6-dibromo-2-naphthyl)oxy]acetyl]carbamothioylamino]-4-methyl-thiophene-3-carboxamide CAS Name: 2-[[[[2-[(1,6-dibromo-2-naphthalenyl)oxy]-1-oxoethyl]amino]-sulfanylidenemethyl]amino]-4-methyl-5-(phenylmethyl)-3-thiophenecarboxamide IUPAC Name: 5-benzyl-2-[[2-(1,6-dibromonaphthalen-2-yl)oxyacetyl]carbamothioylamino]-4-methylthiophene-3-carboxamide Traditional Name: 5-benzyl-2-[[2-(1,6-dibromo-2-naphthoxy)acetyl]thiocarbamoylamino]-4-methyl-thiophene-3-carboxamide Formula: C26H21Br2N3O3S2 MolecularWeight: 647.40124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)COC2=C(C3=C(C=C2)C=C(C=C3)Br)Br)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)COC2=C(C3=C(C=C2)C=C(C=C3)Br)Br)CC4=CC=CC=C4

InChI

InChI=1S/C26H21Br2N3O3S2/c1-14-20(11-15-5-3-2-4-6-15)36-25(22(14)24(29)33)31-26(35)30-21(32)13-34-19-10-7-16-12-17(27)8-9-18(16)23(19)28/h2-10,12H,11,13H2,1H3,(H2,29,33)(H2,30,31,32,35)