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

Systemtic Name: 4-(3-chlorophenyl)-3-ethylsulfanyl-5-(phenylmethyl)-1,2,4-triazole Openeye Name: 3-benzyl-4-(3-chlorophenyl)-5-ethylsulfanyl-1,2,4-triazole CAS Name: 4-(3-chlorophenyl)-3-(ethylthio)-5-(phenylmethyl)-1,2,4-triazole IUPAC Name: 3-benzyl-4-(3-chlorophenyl)-5-ethylsulfanyl-1,2,4-triazole Traditional Name: 3-benzyl-4-(3-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(N1C2=CC(=CC=C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

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

InChI

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