3-(2-methylfuran-3-yl)-4-phenyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 3-(2-methylfuran-3-yl)-4-phenyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-(2-methyl-3-furyl)-4-phenyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-(2-methyl-3-furanyl)-4-phenyl-5-[(2,4,6-trimethylphenyl)methylthio]-1,2,4-triazole IUPAC Name: 3-(2-methylfuran-3-yl)-4-phenyl-5-[(2,4,6-trimethylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-(2-methyl-3-furyl)-4-phenyl-5-[(2,4,6-trimethylbenzyl)thio]-1,2,4-triazole Formula: C23H23N3OS MolecularWeight: 389.51322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)CSC2=NN=C(N2C3=CC=CC=C3)C4=C(OC=C4)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)CSC2=NN=C(N2C3=CC=CC=C3)C4=C(OC=C4)C)C

InChI

InChI=1S/C23H23N3OS/c1-15-12-16(2)21(17(3)13-15)14-28-23-25-24-22(20-10-11-27-18(20)4)26(23)19-8-6-5-7-9-19/h5-13H,14H2,1-4H3