3-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-5-thiophen-2-yl-1,2-oxazole

Systemtic Name: 3-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-5-thiophen-2-yl-1,2-oxazole Openeye Name: 3-[[5-(p-tolyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-5-(2-thienyl)isoxazole CAS Name: 3-[[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]thio]methyl]-5-thiophen-2-ylisoxazole IUPAC Name: 3-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-5-thiophen-2-yl-1,2-oxazole Traditional Name: 3-[[[5-(p-tolyl)-1H-1,2,4-triazol-3-yl]thio]methyl]-5-(2-thienyl)isoxazole Formula: C17H14N4OS2 MolecularWeight: 354.44926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NN2)SCC3=NOC(=C3)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NN2)SCC3=NOC(=C3)C4=CC=CS4

InChI

InChI=1S/C17H14N4OS2/c1-11-4-6-12(7-5-11)16-18-17(20-19-16)24-10-13-9-14(22-21-13)15-3-2-8-23-15/h2-9H,10H2,1H3,(H,18,19,20)