5-(4-methoxy-2,3,6-trimethyl-phenyl)-3-(4-methylsulfanylphenyl)-4,5-dihydro-1H-pyrazole

Systemtic Name: 5-(4-methoxy-2,3,6-trimethyl-phenyl)-3-(4-methylsulfanylphenyl)-4,5-dihydro-1H-pyrazole Openeye Name: 5-(4-methoxy-2,3,6-trimethyl-phenyl)-3-(4-methylsulfanylphenyl)-4,5-dihydro-1H-pyrazole CAS Name: 5-(4-methoxy-2,3,6-trimethylphenyl)-3-[4-(methylthio)phenyl]-4,5-dihydro-1H-pyrazole IUPAC Name: 5-(4-methoxy-2,3,6-trimethylphenyl)-3-(4-methylsulfanylphenyl)-4,5-dihydro-1H-pyrazole Traditional Name: 3-(4-methoxy-2,3,6-trimethyl-phenyl)-5-[4-(methylthio)phenyl]-2-pyrazoline Formula: C20H24N2OS MolecularWeight: 340.48236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C2CC(=NN2)C3=CC=C(C=C3)SC)C)C)OC

Isomeric SMILES

CC1=CC(=C(C(=C1C2CC(=NN2)C3=CC=C(C=C3)SC)C)C)OC

InChI

InChI=1S/C20H24N2OS/c1-12-10-19(23-4)13(2)14(3)20(12)18-11-17(21-22-18)15-6-8-16(24-5)9-7-15/h6-10,18,22H,11H2,1-5H3