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

Systemtic Name: 2-[(4-azanyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-bromanyl-4-methyl-phenyl)ethanamide Openeye Name: 2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-bromo-4-methyl-phenyl)acetamide CAS Name: 2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)thio]-N-(3-bromo-4-methylphenyl)acetamide IUPAC Name: 2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-bromo-4-methylphenyl)acetamide Traditional Name: 2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)thio]-N-(3-bromo-4-methyl-phenyl)acetamide Formula: C12H14BrN5OS MolecularWeight: 356.24146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14BrN5OS/c1-7-3-4-9(5-10(7)13)15-11(19)6-20-12-17-16-8(2)18(12)14/h3-5H,6,14H2,1-2H3,(H,15,19)