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

Systemtic Name: 3-(4-chlorophenyl)-5-ethylsulfanyl-4-(phenylmethyl)-1,2,4-triazole Openeye Name: 4-benzyl-3-(4-chlorophenyl)-5-ethylsulfanyl-1,2,4-triazole CAS Name: 3-(4-chlorophenyl)-5-(ethylthio)-4-(phenylmethyl)-1,2,4-triazole IUPAC Name: 4-benzyl-3-(4-chlorophenyl)-5-ethylsulfanyl-1,2,4-triazole Traditional Name: 4-benzyl-3-(4-chlorophenyl)-5-(ethylthio)-1,2,4-triazole Formula: C17H16ClN3S MolecularWeight: 329.84704

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1CC2=CC=CC=C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCSC1=NN=C(N1CC2=CC=CC=C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H16ClN3S/c1-2-22-17-20-19-16(14-8-10-15(18)11-9-14)21(17)12-13-6-4-3-5-7-13/h3-11H,2,12H2,1H3