4-ethyl-3-[(2-methylphenyl)methylsulfanyl]-5-(5-methyl-4-phenyl-thiophen-3-yl)-1,2,4-triazole

Systemtic Name: 4-ethyl-3-[(2-methylphenyl)methylsulfanyl]-5-(5-methyl-4-phenyl-thiophen-3-yl)-1,2,4-triazole Openeye Name: 4-ethyl-3-(5-methyl-4-phenyl-3-thienyl)-5-(o-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 4-ethyl-3-[(2-methylphenyl)methylthio]-5-(5-methyl-4-phenyl-3-thiophenyl)-1,2,4-triazole IUPAC Name: 4-ethyl-3-[(2-methylphenyl)methylsulfanyl]-5-(5-methyl-4-phenylthiophen-3-yl)-1,2,4-triazole Traditional Name: 4-ethyl-3-[(2-methylbenzyl)thio]-5-(5-methyl-4-phenyl-3-thienyl)-1,2,4-triazole Formula: C23H23N3S2 MolecularWeight: 405.57882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=CC=C2C)C3=CSC(=C3C4=CC=CC=C4)C

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=CC=C2C)C3=CSC(=C3C4=CC=CC=C4)C

InChI

InChI=1S/C23H23N3S2/c1-4-26-22(20-15-27-17(3)21(20)18-11-6-5-7-12-18)24-25-23(26)28-14-19-13-9-8-10-16(19)2/h5-13,15H,4,14H2,1-3H3