6-(3-bromophenyl)-2-methyl-N-[3-(5-methylsulfanyl-1,2,3,4-tetrazol-1-yl)phenyl]pyridine-3-carboxamide

Systemtic Name: 6-(3-bromophenyl)-2-methyl-N-[3-(5-methylsulfanyl-1,2,3,4-tetrazol-1-yl)phenyl]pyridine-3-carboxamide Openeye Name: 6-(3-bromophenyl)-2-methyl-N-[3-(5-methylsulfanyltetrazol-1-yl)phenyl]pyridine-3-carboxamide CAS Name: 6-(3-bromophenyl)-2-methyl-N-[3-[5-(methylthio)-1-tetrazolyl]phenyl]-3-pyridinecarboxamide IUPAC Name: 6-(3-bromophenyl)-2-methyl-N-[3-(5-methylsulfanyltetrazol-1-yl)phenyl]pyridine-3-carboxamide Traditional Name: 6-(3-bromophenyl)-2-methyl-N-[3-[5-(methylthio)tetrazol-1-yl]phenyl]nicotinamide Formula: C21H17BrN6OS MolecularWeight: 481.36828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)C2=CC(=CC=C2)Br)C(=O)NC3=CC=CC(=C3)N4C(=NN=N4)SC

Isomeric SMILES

CC1=C(C=CC(=N1)C2=CC(=CC=C2)Br)C(=O)NC3=CC=CC(=C3)N4C(=NN=N4)SC

InChI

InChI=1S/C21H17BrN6OS/c1-13-18(9-10-19(23-13)14-5-3-6-15(22)11-14)20(29)24-16-7-4-8-17(12-16)28-21(30-2)25-26-27-28/h3-12H,1-2H3,(H,24,29)