3-(ethyldisulfanyl)-5-heptadecyl-4-phenyl-1,2,4-triazole

Systemtic Name: 3-(ethyldisulfanyl)-5-heptadecyl-4-phenyl-1,2,4-triazole Openeye Name: 3-(ethyldisulfanyl)-5-heptadecyl-4-phenyl-1,2,4-triazole CAS Name: 3-(ethyldisulfanyl)-5-heptadecyl-4-phenyl-1,2,4-triazole IUPAC Name: 3-(ethyldisulfanyl)-5-heptadecyl-4-phenyl-1,2,4-triazole Traditional Name: 3-(ethyldisulfanyl)-5-heptadecyl-4-phenyl-1,2,4-triazole Formula: C27H45N3S2 MolecularWeight: 475.7963

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=NN=C(N1C2=CC=CC=C2)SSCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=NN=C(N1C2=CC=CC=C2)SSCC

InChI

InChI=1S/C27H45N3S2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-21-24-26-28-29-27(32-31-4-2)30(26)25-22-19-18-20-23-25/h18-20,22-23H,3-17,21,24H2,1-2H3