N-[2,6-bis(bromanyl)-4-methyl-phenyl]-2-(5-cyano-2-cyclopropyl-6-methyl-pyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-[2,6-bis(bromanyl)-4-methyl-phenyl]-2-(5-cyano-2-cyclopropyl-6-methyl-pyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: 2-(5-cyano-2-cyclopropyl-6-methyl-pyrimidin-4-yl)sulfanyl-N-(2,6-dibromo-4-methyl-phenyl)acetamide CAS Name: 2-[(5-cyano-2-cyclopropyl-6-methyl-4-pyrimidinyl)thio]-N-(2,6-dibromo-4-methylphenyl)acetamide IUPAC Name: 2-(5-cyano-2-cyclopropyl-6-methylpyrimidin-4-yl)sulfanyl-N-(2,6-dibromo-4-methylphenyl)acetamide Traditional Name: 2-[(5-cyano-2-cyclopropyl-6-methyl-pyrimidin-4-yl)thio]-N-(2,6-dibromo-4-methyl-phenyl)acetamide Formula: C18H16Br2N4OS MolecularWeight: 496.21884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)NC(=O)CSC2=NC(=NC(=C2C#N)C)C3CC3)Br

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)NC(=O)CSC2=NC(=NC(=C2C#N)C)C3CC3)Br

InChI

InChI=1S/C18H16Br2N4OS/c1-9-5-13(19)16(14(20)6-9)23-15(25)8-26-18-12(7-21)10(2)22-17(24-18)11-3-4-11/h5-6,11H,3-4,8H2,1-2H3,(H,23,25)