2-(6-azanyl-3,5-dicyano-4-thiophen-2-yl-pyridin-2-yl)sulfanyl-N-(4-bromanyl-2-methyl-phenyl)ethanamide

Systemtic Name: 2-(6-azanyl-3,5-dicyano-4-thiophen-2-yl-pyridin-2-yl)sulfanyl-N-(4-bromanyl-2-methyl-phenyl)ethanamide Openeye Name: 2-[[6-amino-3,5-dicyano-4-(2-thienyl)-2-pyridyl]sulfanyl]-N-(4-bromo-2-methyl-phenyl)acetamide CAS Name: 2-[(6-amino-3,5-dicyano-4-thiophen-2-yl-2-pyridinyl)thio]-N-(4-bromo-2-methylphenyl)acetamide IUPAC Name: 2-(6-amino-3,5-dicyano-4-thiophen-2-ylpyridin-2-yl)sulfanyl-N-(4-bromo-2-methylphenyl)acetamide Traditional Name: 2-[[6-amino-3,5-dicyano-4-(2-thienyl)-2-pyridyl]thio]-N-(4-bromo-2-methyl-phenyl)acetamide Formula: C20H14BrN5OS2 MolecularWeight: 484.39206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CSC2=C(C(=C(C(=N2)N)C#N)C3=CC=CS3)C#N

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CSC2=C(C(=C(C(=N2)N)C#N)C3=CC=CS3)C#N

InChI

InChI=1S/C20H14BrN5OS2/c1-11-7-12(21)4-5-15(11)25-17(27)10-29-20-14(9-23)18(16-3-2-6-28-16)13(8-22)19(24)26-20/h2-7H,10H2,1H3,(H2,24,26)(H,25,27)