N-[2,5-bis(bromanyl)phenyl]-2-(3-cyano-4,6-dimethyl-5-prop-2-enyl-pyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2,5-bis(bromanyl)phenyl]-2-(3-cyano-4,6-dimethyl-5-prop-2-enyl-pyridin-2-yl)sulfanyl-ethanamide Openeye Name: 2-[(5-allyl-3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]-N-(2,5-dibromophenyl)acetamide CAS Name: 2-[(3-cyano-4,6-dimethyl-5-prop-2-enyl-2-pyridinyl)thio]-N-(2,5-dibromophenyl)acetamide IUPAC Name: 2-(3-cyano-4,6-dimethyl-5-prop-2-enylpyridin-2-yl)sulfanyl-N-(2,5-dibromophenyl)acetamide Traditional Name: 2-[(5-allyl-3-cyano-4,6-dimethyl-2-pyridyl)thio]-N-(2,5-dibromophenyl)acetamide Formula: C19H17Br2N3OS MolecularWeight: 495.23078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=C1CC=C)C)SCC(=O)NC2=C(C=CC(=C2)Br)Br)C#N

Isomeric SMILES

CC1=C(C(=NC(=C1CC=C)C)SCC(=O)NC2=C(C=CC(=C2)Br)Br)C#N

InChI

InChI=1S/C19H17Br2N3OS/c1-4-5-14-11(2)15(9-22)19(23-12(14)3)26-10-18(25)24-17-8-13(20)6-7-16(17)21/h4,6-8H,1,5,10H2,2-3H3,(H,24,25)