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

Systemtic Name: 3-(4-methoxyphenyl)-4-(4-methylphenyl)-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole Openeye Name: 3-(4-methoxyphenyl)-5-(1-naphthylmethylsulfanyl)-4-(p-tolyl)-1,2,4-triazole CAS Name: 3-(4-methoxyphenyl)-4-(4-methylphenyl)-5-(1-naphthalenylmethylthio)-1,2,4-triazole IUPAC Name: 3-(4-methoxyphenyl)-4-(4-methylphenyl)-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazole Traditional Name: 3-(4-methoxyphenyl)-5-(1-naphthylmethylthio)-4-(p-tolyl)-1,2,4-triazole Formula: C27H23N3OS MolecularWeight: 437.55602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC4=CC=CC=C43)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC4=CC=CC=C43)C5=CC=C(C=C5)OC

InChI

InChI=1S/C27H23N3OS/c1-19-10-14-23(15-11-19)30-26(21-12-16-24(31-2)17-13-21)28-29-27(30)32-18-22-8-5-7-20-6-3-4-9-25(20)22/h3-17H,18H2,1-2H3