5-[[5,6-bis(4-methylphenyl)-1,2,4-triazin-3-yl]sulfanylmethyl]-3-methyl-1,2-oxazole

Systemtic Name: 5-[[5,6-bis(4-methylphenyl)-1,2,4-triazin-3-yl]sulfanylmethyl]-3-methyl-1,2-oxazole Openeye Name: 5-[[5,6-bis(p-tolyl)-1,2,4-triazin-3-yl]sulfanylmethyl]-3-methyl-isoxazole CAS Name: 5-[[[5,6-bis(4-methylphenyl)-1,2,4-triazin-3-yl]thio]methyl]-3-methylisoxazole IUPAC Name: 5-[[5,6-bis(4-methylphenyl)-1,2,4-triazin-3-yl]sulfanylmethyl]-3-methyl-1,2-oxazole Traditional Name: 5-[[[5,6-bis(p-tolyl)-1,2,4-triazin-3-yl]thio]methyl]-3-methyl-isoxazole Formula: C22H20N4OS MolecularWeight: 388.4854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N=NC(=N2)SCC3=CC(=NO3)C)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N=NC(=N2)SCC3=CC(=NO3)C)C4=CC=C(C=C4)C

InChI

InChI=1S/C22H20N4OS/c1-14-4-8-17(9-5-14)20-21(18-10-6-15(2)7-11-18)24-25-22(23-20)28-13-19-12-16(3)26-27-19/h4-12H,13H2,1-3H3