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

Systemtic Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-(phenylmethyl)-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-benzyl-5-[(4-chlorophenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-[(4-chlorophenyl)methylthio]-5-(phenylmethyl)-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-benzyl-5-[(4-chlorophenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-benzyl-5-[(4-chlorobenzyl)thio]-1,2,4-triazole Formula: C19H18ClN3S MolecularWeight: 355.88432

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC2=CC=C(C=C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

C=CCN1C(=NN=C1SCC2=CC=C(C=C2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C19H18ClN3S/c1-2-12-23-18(13-15-6-4-3-5-7-15)21-22-19(23)24-14-16-8-10-17(20)11-9-16/h2-11H,1,12-14H2