4-[[5-(4-tert-butylphenyl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-2-ethyl-1,3-thiazole

Systemtic Name: 4-[[5-(4-tert-butylphenyl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-2-ethyl-1,3-thiazole Openeye Name: 4-[[5-(4-tert-butylphenyl)-4-(2-furylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-2-ethyl-thiazole CAS Name: 4-[[[5-(4-tert-butylphenyl)-4-(2-furanylmethyl)-1,2,4-triazol-3-yl]thio]methyl]-2-ethylthiazole IUPAC Name: 4-[[5-(4-tert-butylphenyl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-2-ethyl-1,3-thiazole Traditional Name: 4-[[[5-(4-tert-butylphenyl)-4-(2-furfuryl)-1,2,4-triazol-3-yl]thio]methyl]-2-ethyl-thiazole Formula: C23H26N4OS2 MolecularWeight: 438.60874

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=CS1)CSC2=NN=C(N2CC3=CC=CO3)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CCC1=NC(=CS1)CSC2=NN=C(N2CC3=CC=CO3)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C23H26N4OS2/c1-5-20-24-18(14-29-20)15-30-22-26-25-21(27(22)13-19-7-6-12-28-19)16-8-10-17(11-9-16)23(2,3)4/h6-12,14H,5,13,15H2,1-4H3