1-[2-[[2,6-bis(bromanyl)-4-methyl-phenyl]amino]-2-oxidanylidene-ethanethioyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-[[2,6-bis(bromanyl)-4-methyl-phenyl]amino]-2-oxidanylidene-ethanethioyl]piperidine-4-carboxamide Openeye Name: 1-[2-(2,6-dibromo-4-methyl-anilino)-2-oxo-ethanethioyl]piperidine-4-carboxamide CAS Name: 1-[2-(2,6-dibromo-4-methylanilino)-2-oxo-1-sulfanylideneethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(2,6-dibromo-4-methylanilino)-2-oxoethanethioyl]piperidine-4-carboxamide Traditional Name: 1-[2-(2,6-dibromo-4-methyl-anilino)-2-keto-thioacetyl]isonipecotamide Formula: C15H17Br2N3O2S MolecularWeight: 463.18738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)NC(=O)C(=S)N2CCC(CC2)C(=O)N)Br

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)NC(=O)C(=S)N2CCC(CC2)C(=O)N)Br

InChI

InChI=1S/C15H17Br2N3O2S/c1-8-6-10(16)12(11(17)7-8)19-14(22)15(23)20-4-2-9(3-5-20)13(18)21/h6-7,9H,2-5H2,1H3,(H2,18,21)(H,19,22)