3-[(3-phenoxyphenyl)methylsulfanyl]-5-propyl-1H-1,2,4-triazole

Systemtic Name: 3-[(3-phenoxyphenyl)methylsulfanyl]-5-propyl-1H-1,2,4-triazole Openeye Name: 3-[(3-phenoxyphenyl)methylsulfanyl]-5-propyl-1H-1,2,4-triazole CAS Name: 3-[(3-phenoxyphenyl)methylthio]-5-propyl-1H-1,2,4-triazole IUPAC Name: 3-[(3-phenoxyphenyl)methylsulfanyl]-5-propyl-1H-1,2,4-triazole Traditional Name: 3-[(3-phenoxybenzyl)thio]-5-propyl-1H-1,2,4-triazole Formula: C18H19N3OS MolecularWeight: 325.42796

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NN1)SCC2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CCCC1=NC(=NN1)SCC2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C18H19N3OS/c1-2-7-17-19-18(21-20-17)23-13-14-8-6-11-16(12-14)22-15-9-4-3-5-10-15/h3-6,8-12H,2,7,13H2,1H3,(H,19,20,21)