methyl 3-[[2-(3-methoxy-3-oxidanylidene-propyl)sulfanyl-1,4-dihydro-1,3,5-triazin-4-yl]sulfanyl]propanoate

Systemtic Name: methyl 3-[[2-(3-methoxy-3-oxidanylidene-propyl)sulfanyl-1,4-dihydro-1,3,5-triazin-4-yl]sulfanyl]propanoate Openeye Name: methyl 3-[[2-(3-methoxy-3-oxo-propyl)sulfanyl-1,4-dihydro-1,3,5-triazin-4-yl]sulfanyl]propanoate CAS Name: 3-[[2-[(3-methoxy-3-oxopropyl)thio]-1,4-dihydro-1,3,5-triazin-4-yl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[[2-(3-methoxy-3-oxopropyl)sulfanyl-1,4-dihydro-1,3,5-triazin-4-yl]sulfanyl]propanoate Traditional Name: 3-[[2-[(3-keto-3-methoxy-propyl)thio]-1,4-dihydro-s-triazin-4-yl]thio]propionic acid methyl ester Formula: C11H17N3O4S2 MolecularWeight: 319.40038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSC1N=CNC(=N1)SCCC(=O)OC

Isomeric SMILES

COC(=O)CCSC1N=CNC(=N1)SCCC(=O)OC

InChI

InChI=1S/C11H17N3O4S2/c1-17-8(15)3-5-19-10-12-7-13-11(14-10)20-6-4-9(16)18-2/h7,10H,3-6H2,1-2H3,(H,12,13,14)