[4,6-bis(azanyl)-1,3,5-triazin-2-yl]methyl (2R)-2-phenylsulfanylpropanoate

Systemtic Name: [4,6-bis(azanyl)-1,3,5-triazin-2-yl]methyl (2R)-2-phenylsulfanylpropanoate Openeye Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl (2R)-2-phenylsulfanylpropanoate CAS Name: (2R)-2-(phenylthio)propanoic acid (4,6-diamino-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl (2R)-2-phenylsulfanylpropanoate Traditional Name: (2R)-2-(phenylthio)propionic acid (4,6-diamino-s-triazin-2-yl)methyl ester Formula: C13H15N5O2S MolecularWeight: 305.3555

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=NC(=NC(=N1)N)N)SC2=CC=CC=C2

Isomeric SMILES

C[C@H](C(=O)OCC1=NC(=NC(=N1)N)N)SC2=CC=CC=C2

InChI

InChI=1S/C13H15N5O2S/c1-8(21-9-5-3-2-4-6-9)11(19)20-7-10-16-12(14)18-13(15)17-10/h2-6,8H,7H2,1H3,(H4,14,15,16,17,18)/t8-/m1/s1