3-(2-methoxyphenyl)-5-(2-methylprop-2-enylsulfanyl)-4-phenethyl-1,2,4-triazole

Systemtic Name: 3-(2-methoxyphenyl)-5-(2-methylprop-2-enylsulfanyl)-4-phenethyl-1,2,4-triazole Openeye Name: 3-(2-methoxyphenyl)-5-(2-methylallylsulfanyl)-4-phenethyl-1,2,4-triazole CAS Name: 3-(2-methoxyphenyl)-5-(2-methylprop-2-enylthio)-4-phenethyl-1,2,4-triazole IUPAC Name: 3-(2-methoxyphenyl)-5-(2-methylprop-2-enylsulfanyl)-4-phenethyl-1,2,4-triazole Traditional Name: 3-(2-methoxyphenyl)-5-(2-methylallylthio)-4-phenethyl-1,2,4-triazole Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CSC1=NN=C(N1CCC2=CC=CC=C2)C3=CC=CC=C3OC

Isomeric SMILES

CC(=C)CSC1=NN=C(N1CCC2=CC=CC=C2)C3=CC=CC=C3OC

InChI

InChI=1S/C21H23N3OS/c1-16(2)15-26-21-23-22-20(18-11-7-8-12-19(18)25-3)24(21)14-13-17-9-5-4-6-10-17/h4-12H,1,13-15H2,2-3H3