dodecyl 3-[[4-chloranyl-6-(3-dodecoxy-3-oxidanylidene-propyl)sulfanyl-1,3,5-triazin-2-yl]sulfanyl]propanoate

Systemtic Name: dodecyl 3-[[4-chloranyl-6-(3-dodecoxy-3-oxidanylidene-propyl)sulfanyl-1,3,5-triazin-2-yl]sulfanyl]propanoate Openeye Name: dodecyl 3-[[4-chloro-6-(3-dodecoxy-3-oxo-propyl)sulfanyl-1,3,5-triazin-2-yl]sulfanyl]propanoate CAS Name: 3-[[4-chloro-6-[(3-dodecoxy-3-oxopropyl)thio]-1,3,5-triazin-2-yl]thio]propanoic acid dodecyl ester IUPAC Name: dodecyl 3-[[4-chloro-6-(3-dodecoxy-3-oxopropyl)sulfanyl-1,3,5-triazin-2-yl]sulfanyl]propanoate Traditional Name: 3-[[4-chloro-6-[(3-keto-3-lauryloxy-propyl)thio]-s-triazin-2-yl]thio]propionic acid lauryl ester Formula: C33H58ClN3O4S2 MolecularWeight: 660.41432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CCSC1=NC(=NC(=N1)Cl)SCCC(=O)OCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CCSC1=NC(=NC(=N1)Cl)SCCC(=O)OCCCCCCCCCCCC

InChI

InChI=1S/C33H58ClN3O4S2/c1-3-5-7-9-11-13-15-17-19-21-25-40-29(38)23-27-42-32-35-31(34)36-33(37-32)43-28-24-30(39)41-26-22-20-18-16-14-12-10-8-6-4-2/h3-28H2,1-2H3