5-(4-ethylphenyl)-3-(1-phenylethylsulfanyl)-1H-1,2,4-triazole

Systemtic Name: 5-(4-ethylphenyl)-3-(1-phenylethylsulfanyl)-1H-1,2,4-triazole Openeye Name: 5-(4-ethylphenyl)-3-(1-phenylethylsulfanyl)-1H-1,2,4-triazole CAS Name: 5-(4-ethylphenyl)-3-(1-phenylethylthio)-1H-1,2,4-triazole IUPAC Name: 5-(4-ethylphenyl)-3-(1-phenylethylsulfanyl)-1H-1,2,4-triazole Traditional Name: 5-(4-ethylphenyl)-3-(1-phenylethylthio)-1H-1,2,4-triazole Formula: C18H19N3S MolecularWeight: 309.42856

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=NN2)SC(C)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=NN2)SC(C)C3=CC=CC=C3

InChI

InChI=1S/C18H19N3S/c1-3-14-9-11-16(12-10-14)17-19-18(21-20-17)22-13(2)15-7-5-4-6-8-15/h4-13H,3H2,1-2H3,(H,19,20,21)