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5-dodecyl-1-phenyl-3-[(phenylmethyl)disulfanyl]-1,2,4-triazole

Systemtic Name:	5-dodecyl-1-phenyl-3-[(phenylmethyl)disulfanyl]-1,2,4-triazole
Openeye Name:	3-(benzyldisulfanyl)-5-dodecyl-1-phenyl-1,2,4-triazole
CAS Name:	5-dodecyl-1-phenyl-3-[(phenylmethyl)disulfanyl]-1,2,4-triazole
IUPAC Name:	3-(benzyldisulfanyl)-5-dodecyl-1-phenyl-1,2,4-triazole
Traditional Name:	3-(benzyldisulfanyl)-5-lauryl-1-phenyl-1,2,4-triazole
Formula:	C₂₇H₃₇N₃S₂
MolecularWeight:	467.73278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=NC(=NN1C2=CC=CC=C2)SSCC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCCC1=NC(=NN1C2=CC=CC=C2)SSCC3=CC=CC=C3

InChI

InChI=1S/C27H37N3S2/c1-2-3-4-5-6-7-8-9-10-17-22-26-28-27(29-30(26)25-20-15-12-16-21-25)32-31-23-24-18-13-11-14-19-24/h11-16,18-21H,2-10,17,22-23H2,1H3

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