3-[(4-chloranylphenoxy)methyl]-5-ethylsulfanyl-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-[(4-chloranylphenoxy)methyl]-5-ethylsulfanyl-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[(4-chlorophenoxy)methyl]-5-ethylsulfanyl-1,2,4-triazole CAS Name: 3-[(4-chlorophenoxy)methyl]-5-(ethylthio)-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(4-chlorophenoxy)methyl]-5-ethylsulfanyl-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(4-chlorophenoxy)methyl]-5-(ethylthio)-1,2,4-triazole Formula: C14H16ClN3OS MolecularWeight: 309.81434

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1CC=C)COC2=CC=C(C=C2)Cl

Isomeric SMILES

CCSC1=NN=C(N1CC=C)COC2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H16ClN3OS/c1-3-9-18-13(16-17-14(18)20-4-2)10-19-12-7-5-11(15)6-8-12/h3,5-8H,1,4,9-10H2,2H3