2-[[4-azanyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[2,6-bis(bromanyl)-4-methyl-phenyl]ethanamide

Systemtic Name: 2-[[4-azanyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[2,6-bis(bromanyl)-4-methyl-phenyl]ethanamide Openeye Name: 2-[[4-amino-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,6-dibromo-4-methyl-phenyl)acetamide CAS Name: 2-[[4-amino-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-(2,6-dibromo-4-methylphenyl)acetamide IUPAC Name: 2-[[4-amino-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,6-dibromo-4-methylphenyl)acetamide Traditional Name: 2-[[4-amino-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-(2,6-dibromo-4-methyl-phenyl)acetamide Formula: C18H17Br2N5O2S MolecularWeight: 527.23288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)NC(=O)CSC2=NN=C(N2N)C3=CC=CC=C3OC)Br

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)NC(=O)CSC2=NN=C(N2N)C3=CC=CC=C3OC)Br

InChI

InChI=1S/C18H17Br2N5O2S/c1-10-7-12(19)16(13(20)8-10)22-15(26)9-28-18-24-23-17(25(18)21)11-5-3-4-6-14(11)27-2/h3-8H,9,21H2,1-2H3,(H,22,26)