N-[2,6-bis(bromanyl)-4-methyl-phenyl]-2-(pyridin-3-ylmethylamino)-2-sulfanylidene-ethanamide

Systemtic Name: N-[2,6-bis(bromanyl)-4-methyl-phenyl]-2-(pyridin-3-ylmethylamino)-2-sulfanylidene-ethanamide Openeye Name: N-(2,6-dibromo-4-methyl-phenyl)-2-(3-pyridylmethylamino)-2-thioxo-acetamide CAS Name: N-(2,6-dibromo-4-methylphenyl)-2-(3-pyridinylmethylamino)-2-sulfanylideneacetamide IUPAC Name: N-(2,6-dibromo-4-methylphenyl)-2-(pyridin-3-ylmethylamino)-2-sulfanylideneacetamide Traditional Name: N-(2,6-dibromo-4-methyl-phenyl)-2-(3-pyridylmethylamino)-2-thioxo-acetamide Formula: C15H13Br2N3OS MolecularWeight: 443.15622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)NC(=O)C(=S)NCC2=CN=CC=C2)Br

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)NC(=O)C(=S)NCC2=CN=CC=C2)Br

InChI

InChI=1S/C15H13Br2N3OS/c1-9-5-11(16)13(12(17)6-9)20-14(21)15(22)19-8-10-3-2-4-18-7-10/h2-7H,8H2,1H3,(H,19,22)(H,20,21)