5-ethyl-3-(triphenylmethyl)sulfanyl-1H-1,2,4-triazole

Systemtic Name: 5-ethyl-3-(triphenylmethyl)sulfanyl-1H-1,2,4-triazole Openeye Name: 5-ethyl-3-tritylsulfanyl-1H-1,2,4-triazole CAS Name: 5-ethyl-3-[(triphenylmethyl)thio]-1H-1,2,4-triazole IUPAC Name: 5-ethyl-3-tritylsulfanyl-1H-1,2,4-triazole Traditional Name: 5-ethyl-3-(tritylthio)-1H-1,2,4-triazole Formula: C23H21N3S MolecularWeight: 371.49794

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NN1)SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCC1=NC(=NN1)SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H21N3S/c1-2-21-24-22(26-25-21)27-23(18-12-6-3-7-13-18,19-14-8-4-9-15-19)20-16-10-5-11-17-20/h3-17H,2H2,1H3,(H,24,25,26)