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

Systemtic Name: 4-methyl-3-[(2-methylphenyl)methylsulfanyl]-5-(5-methyl-4-phenyl-thiophen-3-yl)-1,2,4-triazole Openeye Name: 4-methyl-3-(5-methyl-4-phenyl-3-thienyl)-5-(o-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 4-methyl-3-[(2-methylphenyl)methylthio]-5-(5-methyl-4-phenyl-3-thiophenyl)-1,2,4-triazole IUPAC Name: 4-methyl-3-[(2-methylphenyl)methylsulfanyl]-5-(5-methyl-4-phenylthiophen-3-yl)-1,2,4-triazole Traditional Name: 4-methyl-3-[(2-methylbenzyl)thio]-5-(5-methyl-4-phenyl-3-thienyl)-1,2,4-triazole Formula: C22H21N3S2 MolecularWeight: 391.55224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NN=C(N2C)C3=CSC(=C3C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=CC=C1CSC2=NN=C(N2C)C3=CSC(=C3C4=CC=CC=C4)C

InChI

InChI=1S/C22H21N3S2/c1-15-9-7-8-12-18(15)13-27-22-24-23-21(25(22)3)19-14-26-16(2)20(19)17-10-5-4-6-11-17/h4-12,14H,13H2,1-3H3