3,5-bis(bromanyl)-N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-2-methoxy-benzamide

Systemtic Name: 3,5-bis(bromanyl)-N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-2-methoxy-benzamide Openeye Name: 3,5-dibromo-N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-2-methoxy-benzamide CAS Name: 3,5-dibromo-N-[(1,2-dihydroacenaphthylen-5-ylamino)-sulfanylidenemethyl]-2-methoxybenzamide IUPAC Name: 3,5-dibromo-N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-2-methoxybenzamide Traditional Name: N-(acenaphthen-5-ylthiocarbamoyl)-3,5-dibromo-2-methoxy-benzamide Formula: C21H16Br2N2O2S MolecularWeight: 520.23694

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C(=O)NC(=S)NC2=C3C=CC=C4C3=C(CC4)C=C2)Br)Br

Isomeric SMILES

COC1=C(C=C(C=C1C(=O)NC(=S)NC2=C3C=CC=C4C3=C(CC4)C=C2)Br)Br

InChI

InChI=1S/C21H16Br2N2O2S/c1-27-19-15(9-13(22)10-16(19)23)20(26)25-21(28)24-17-8-7-12-6-5-11-3-2-4-14(17)18(11)12/h2-4,7-10H,5-6H2,1H3,(H2,24,25,26,28)