4-(3-chlorophenyl)-3-(phenylmethyl)-5-prop-2-enylsulfanyl-1,2,4-triazole

Systemtic Name: 4-(3-chlorophenyl)-3-(phenylmethyl)-5-prop-2-enylsulfanyl-1,2,4-triazole Openeye Name: 3-allylsulfanyl-5-benzyl-4-(3-chlorophenyl)-1,2,4-triazole CAS Name: 4-(3-chlorophenyl)-3-(phenylmethyl)-5-(prop-2-enylthio)-1,2,4-triazole IUPAC Name: 3-benzyl-4-(3-chlorophenyl)-5-prop-2-enylsulfanyl-1,2,4-triazole Traditional Name: 3-(allylthio)-5-benzyl-4-(3-chlorophenyl)-1,2,4-triazole Formula: C18H16ClN3S MolecularWeight: 341.85774

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NN=C(N1C2=CC(=CC=C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

C=CCSC1=NN=C(N1C2=CC(=CC=C2)Cl)CC3=CC=CC=C3

InChI

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