2-[5-(4-bromophenyl)-3-methyl-1,2,4-triazol-1-yl]-5-methylsulfonyl-pyridine

Systemtic Name: 2-[5-(4-bromophenyl)-3-methyl-1,2,4-triazol-1-yl]-5-methylsulfonyl-pyridine Openeye Name: 2-[5-(4-bromophenyl)-3-methyl-1,2,4-triazol-1-yl]-5-methylsulfonyl-pyridine CAS Name: 2-[5-(4-bromophenyl)-3-methyl-1,2,4-triazol-1-yl]-5-methylsulfonylpyridine IUPAC Name: 2-[5-(4-bromophenyl)-3-methyl-1,2,4-triazol-1-yl]-5-methylsulfonylpyridine Traditional Name: 2-[5-(4-bromophenyl)-3-methyl-1,2,4-triazol-1-yl]-5-mesyl-pyridine Formula: C15H13BrN4O2S MolecularWeight: 393.25832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=N1)C2=CC=C(C=C2)Br)C3=NC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=NN(C(=N1)C2=CC=C(C=C2)Br)C3=NC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C15H13BrN4O2S/c1-10-18-15(11-3-5-12(16)6-4-11)20(19-10)14-8-7-13(9-17-14)23(2,21)22/h3-9H,1-2H3