N-[2-[(5-bromanyl-2-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]-2,6-dimethoxy-benzamide

Systemtic Name: N-[2-[(5-bromanyl-2-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]-2,6-dimethoxy-benzamide Openeye Name: N-[2-[(5-bromo-2-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]-2,6-dimethoxy-benzamide CAS Name: N-[2-[(5-bromo-2-methyl-1,2,4-triazol-3-yl)thio]phenyl]-2,6-dimethoxybenzamide IUPAC Name: N-[2-[(5-bromo-2-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]-2,6-dimethoxybenzamide Traditional Name: N-[2-[(5-bromo-2-methyl-1,2,4-triazol-3-yl)thio]phenyl]-2,6-dimethoxy-benzamide Formula: C18H17BrN4O3S MolecularWeight: 449.32158

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=N1)Br)SC2=CC=CC=C2NC(=O)C3=C(C=CC=C3OC)OC

Isomeric SMILES

CN1C(=NC(=N1)Br)SC2=CC=CC=C2NC(=O)C3=C(C=CC=C3OC)OC

InChI

InChI=1S/C18H17BrN4O3S/c1-23-18(21-17(19)22-23)27-14-10-5-4-7-11(14)20-16(24)15-12(25-2)8-6-9-13(15)26-3/h4-10H,1-3H3,(H,20,24)