4-(furan-2-ylmethyl)-3-(4-methoxyphenyl)-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 4-(furan-2-ylmethyl)-3-(4-methoxyphenyl)-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole Openeye Name: 4-(2-furylmethyl)-3-(4-methoxyphenyl)-5-(1-naphthylmethylsulfanyl)-1,2,4-triazole CAS Name: 4-(2-furanylmethyl)-3-(4-methoxyphenyl)-5-(1-naphthalenylmethylthio)-1,2,4-triazole IUPAC Name: 4-(furan-2-ylmethyl)-3-(4-methoxyphenyl)-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole Traditional Name: 4-(2-furfuryl)-3-(4-methoxyphenyl)-5-(1-naphthylmethylthio)-1,2,4-triazole Formula: C25H21N3O2S MolecularWeight: 427.51814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(N2CC3=CC=CO3)SCC4=CC=CC5=CC=CC=C54

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(N2CC3=CC=CO3)SCC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C25H21N3O2S/c1-29-21-13-11-19(12-14-21)24-26-27-25(28(24)16-22-9-5-15-30-22)31-17-20-8-4-7-18-6-2-3-10-23(18)20/h2-15H,16-17H2,1H3