3-[3,5-bis(bromanyl)-2-methoxy-phenyl]-N-(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)prop-2-enamide

Systemtic Name: 3-[3,5-bis(bromanyl)-2-methoxy-phenyl]-N-(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)prop-2-enamide Openeye Name: 3-(3,5-dibromo-2-methoxy-phenyl)-N-(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)prop-2-enamide CAS Name: 3-(3,5-dibromo-2-methoxyphenyl)-N-[3-methyl-5-(methylthio)-1,2,4-triazol-4-yl]-2-propenamide IUPAC Name: 3-(3,5-dibromo-2-methoxyphenyl)-N-(3-methyl-5-methylsulfanyl-1,2,4-triazol-4-yl)prop-2-enamide Traditional Name: 3-(3,5-dibromo-2-methoxy-phenyl)-N-[3-methyl-5-(methylthio)-1,2,4-triazol-4-yl]acrylamide Formula: C14H14Br2N4O2S MolecularWeight: 462.15956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1NC(=O)C=CC2=CC(=CC(=C2OC)Br)Br)SC

Isomeric SMILES

CC1=NN=C(N1NC(=O)C=CC2=CC(=CC(=C2OC)Br)Br)SC

InChI

InChI=1S/C14H14Br2N4O2S/c1-8-17-18-14(23-3)20(8)19-12(21)5-4-9-6-10(15)7-11(16)13(9)22-2/h4-7H,1-3H3,(H,19,21)