5-[(4-chloranyl-3-methyl-phenoxy)methyl]-3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole

Systemtic Name: 5-[(4-chloranyl-3-methyl-phenoxy)methyl]-3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-[(4-chloro-3-methyl-phenoxy)methyl]-3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-[(4-chloro-3-methylphenoxy)methyl]-3-[(3-methoxyphenyl)methylthio]-1H-1,2,4-triazole IUPAC Name: 5-[(4-chloro-3-methylphenoxy)methyl]-3-[(3-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-[(4-chloro-3-methyl-phenoxy)methyl]-3-(m-anisylthio)-1H-1,2,4-triazole Formula: C18H18ClN3O2S MolecularWeight: 375.87242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=NC(=NN2)SCC3=CC(=CC=C3)OC)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=NC(=NN2)SCC3=CC(=CC=C3)OC)Cl

InChI

InChI=1S/C18H18ClN3O2S/c1-12-8-15(6-7-16(12)19)24-10-17-20-18(22-21-17)25-11-13-4-3-5-14(9-13)23-2/h3-9H,10-11H2,1-2H3,(H,20,21,22)