3-(4-bromanyl-2-methyl-pyrazol-3-yl)-N-(4-methylsulfanylphenyl)aniline

Systemtic Name: 3-(4-bromanyl-2-methyl-pyrazol-3-yl)-N-(4-methylsulfanylphenyl)aniline Openeye Name: 3-(4-bromo-2-methyl-pyrazol-3-yl)-N-(4-methylsulfanylphenyl)aniline CAS Name: 3-(4-bromo-2-methyl-3-pyrazolyl)-N-[4-(methylthio)phenyl]aniline IUPAC Name: 3-(4-bromo-2-methylpyrazol-3-yl)-N-(4-methylsulfanylphenyl)aniline Traditional Name: [3-(4-bromo-2-methyl-pyrazol-3-yl)phenyl]-[4-(methylthio)phenyl]amine Formula: C17H16BrN3S MolecularWeight: 374.29804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)Br)C2=CC(=CC=C2)NC3=CC=C(C=C3)SC

Isomeric SMILES

CN1C(=C(C=N1)Br)C2=CC(=CC=C2)NC3=CC=C(C=C3)SC

InChI

InChI=1S/C17H16BrN3S/c1-21-17(16(18)11-19-21)12-4-3-5-14(10-12)20-13-6-8-15(22-2)9-7-13/h3-11,20H,1-2H3