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

Systemtic Name: 3-(naphthalen-1-ylmethylsulfanyl)-4-(oxolan-2-ylmethyl)-5-propan-2-yl-1,2,4-triazole Openeye Name: 3-isopropyl-5-(1-naphthylmethylsulfanyl)-4-(tetrahydrofuran-2-ylmethyl)-1,2,4-triazole CAS Name: 3-(1-naphthalenylmethylthio)-4-(2-oxolanylmethyl)-5-propan-2-yl-1,2,4-triazole IUPAC Name: 3-(naphthalen-1-ylmethylsulfanyl)-4-(oxolan-2-ylmethyl)-5-propan-2-yl-1,2,4-triazole Traditional Name: 3-isopropyl-5-(1-naphthylmethylthio)-4-(tetrahydrofurfuryl)-1,2,4-triazole Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1CC2CCCO2)SCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)C1=NN=C(N1CC2CCCO2)SCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H25N3OS/c1-15(2)20-22-23-21(24(20)13-18-10-6-12-25-18)26-14-17-9-5-8-16-7-3-4-11-19(16)17/h3-5,7-9,11,15,18H,6,10,12-14H2,1-2H3