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4-(4-ethoxyphenyl)-3-heptyl-5-(octadecyldisulfanyl)-1,2,4-triazole

4-(4-ethoxyphenyl)-3-heptyl-5-(octadecyldisulfanyl)-1,2,4-triazole

Systemtic Name:4-(4-ethoxyphenyl)-3-heptyl-5-(octadecyldisulfanyl)-1,2,4-triazole
Openeye Name:4-(4-ethoxyphenyl)-3-heptyl-5-(octadecyldisulfanyl)-1,2,4-triazole
CAS Name:4-(4-ethoxyphenyl)-3-heptyl-5-(octadecyldisulfanyl)-1,2,4-triazole
IUPAC Name:4-(4-ethoxyphenyl)-3-heptyl-5-(octadecyldisulfanyl)-1,2,4-triazole
Traditional Name:3-heptyl-4-p-phenetyl-5-(stearyldisulfanyl)-1,2,4-triazole
Formula: C35H61N3OS2
MolecularWeight: 604.00834
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCSSC1=NN=C(N1C2=CC=C(C=C2)OCC)CCCCCCC


Isomeric SMILES

CCCCCCCCCCCCCCCCCCSSC1=NN=C(N1C2=CC=C(C=C2)OCC)CCCCCCC


InChI

InChI=1S/C35H61N3OS2/c1-4-7-9-11-12-13-14-15-16-17-18-19-20-21-23-25-31-40-41-35-37-36-34(26-24-22-10-8-5-2)38(35)32-27-29-33(30-28-32)39-6-3/h27-30H,4-26,31H2,1-3H3


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