3-[(4-chlorophenyl)methylsulfanyl]-5-phenyl-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-phenyl-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[(4-chlorophenyl)methylsulfanyl]-5-phenyl-1,2,4-triazole CAS Name: 3-[(4-chlorophenyl)methylthio]-5-phenyl-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-phenyl-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(4-chlorobenzyl)thio]-5-phenyl-1,2,4-triazole Formula: C18H16ClN3S MolecularWeight: 341.85774

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC2=CC=C(C=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

C=CCN1C(=NN=C1SCC2=CC=C(C=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C18H16ClN3S/c1-2-12-22-17(15-6-4-3-5-7-15)20-21-18(22)23-13-14-8-10-16(19)11-9-14/h2-11H,1,12-13H2