octyl 3-[1-oxidanylidene-1-(1,3,5-triazin-2-yl)propan-2-yl]sulfanylpropanoate

Systemtic Name: octyl 3-[1-oxidanylidene-1-(1,3,5-triazin-2-yl)propan-2-yl]sulfanylpropanoate Openeye Name: octyl 3-[1-methyl-2-oxo-2-(1,3,5-triazin-2-yl)ethyl]sulfanylpropanoate CAS Name: 3-[[1-oxo-1-(1,3,5-triazin-2-yl)propan-2-yl]thio]propanoic acid octyl ester IUPAC Name: octyl 3-[1-oxo-1-(1,3,5-triazin-2-yl)propan-2-yl]sulfanylpropanoate Traditional Name: 3-[[2-keto-1-methyl-2-(s-triazin-2-yl)ethyl]thio]propionic acid octyl ester Formula: C17H27N3O3S MolecularWeight: 353.47958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)CCSC(C)C(=O)C1=NC=NC=N1

Isomeric SMILES

CCCCCCCCOC(=O)CCSC(C)C(=O)C1=NC=NC=N1

InChI

InChI=1S/C17H27N3O3S/c1-3-4-5-6-7-8-10-23-15(21)9-11-24-14(2)16(22)17-19-12-18-13-20-17/h12-14H,3-11H2,1-2H3