3-(naphthalen-1-ylmethylsulfanyl)-4-(oxolan-2-ylmethyl)-5-thiophen-2-yl-1,2,4-triazole

Systemtic Name: 3-(naphthalen-1-ylmethylsulfanyl)-4-(oxolan-2-ylmethyl)-5-thiophen-2-yl-1,2,4-triazole Openeye Name: 3-(1-naphthylmethylsulfanyl)-4-(tetrahydrofuran-2-ylmethyl)-5-(2-thienyl)-1,2,4-triazole CAS Name: 3-(1-naphthalenylmethylthio)-4-(2-oxolanylmethyl)-5-thiophen-2-yl-1,2,4-triazole IUPAC Name: 3-(naphthalen-1-ylmethylsulfanyl)-4-(oxolan-2-ylmethyl)-5-thiophen-2-yl-1,2,4-triazole Traditional Name: 3-(1-naphthylmethylthio)-4-(tetrahydrofurfuryl)-5-(2-thienyl)-1,2,4-triazole Formula: C22H21N3OS2 MolecularWeight: 407.55164

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=NN=C2SCC3=CC=CC4=CC=CC=C43)C5=CC=CS5

Isomeric SMILES

C1CC(OC1)CN2C(=NN=C2SCC3=CC=CC4=CC=CC=C43)C5=CC=CS5

InChI

InChI=1S/C22H21N3OS2/c1-2-10-19-16(6-1)7-3-8-17(19)15-28-22-24-23-21(20-11-5-13-27-20)25(22)14-18-9-4-12-26-18/h1-3,5-8,10-11,13,18H,4,9,12,14-15H2