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

Systemtic Name: N-[2-[(5-bromanyl-2-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]-4-methyl-benzamide Openeye Name: N-[2-[(5-bromo-2-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]-4-methyl-benzamide CAS Name: N-[2-[(5-bromo-2-methyl-1,2,4-triazol-3-yl)thio]phenyl]-4-methylbenzamide IUPAC Name: N-[2-[(5-bromo-2-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]-4-methylbenzamide Traditional Name: N-[2-[(5-bromo-2-methyl-1,2,4-triazol-3-yl)thio]phenyl]-4-methyl-benzamide Formula: C17H15BrN4OS MolecularWeight: 403.2962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2SC3=NC(=NN3C)Br

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2SC3=NC(=NN3C)Br

InChI

InChI=1S/C17H15BrN4OS/c1-11-7-9-12(10-8-11)15(23)19-13-5-3-4-6-14(13)24-17-20-16(18)21-22(17)2/h3-10H,1-2H3,(H,19,23)