3-(oxan-2-ylmethylsulfanyl)-4-phenyl-5-thiophen-2-yl-1,2,4-triazole

Systemtic Name: 3-(oxan-2-ylmethylsulfanyl)-4-phenyl-5-thiophen-2-yl-1,2,4-triazole Openeye Name: 4-phenyl-3-(tetrahydropyran-2-ylmethylsulfanyl)-5-(2-thienyl)-1,2,4-triazole CAS Name: 3-(2-oxanylmethylthio)-4-phenyl-5-thiophen-2-yl-1,2,4-triazole IUPAC Name: 3-(oxan-2-ylmethylsulfanyl)-4-phenyl-5-thiophen-2-yl-1,2,4-triazole Traditional Name: 4-phenyl-3-(tetrahydropyran-2-ylmethylthio)-5-(2-thienyl)-1,2,4-triazole Formula: C18H19N3OS2 MolecularWeight: 357.49296

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

C1CCOC(C1)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C18H19N3OS2/c1-2-7-14(8-3-1)21-17(16-10-6-12-23-16)19-20-18(21)24-13-15-9-4-5-11-22-15/h1-3,6-8,10,12,15H,4-5,9,11,13H2