(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl (2R)-2-(4-chlorophenyl)sulfanylpropanoate

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl (2R)-2-(4-chlorophenyl)sulfanylpropanoate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl (2R)-2-(4-chlorophenyl)sulfanylpropanoate CAS Name: (2R)-2-[(4-chlorophenyl)thio]propanoic acid (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl (2R)-2-(4-chlorophenyl)sulfanylpropanoate Traditional Name: (2R)-2-[(4-chlorophenyl)thio]propionic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C19H18ClN5O2S MolecularWeight: 415.89652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=NC(=NC(=N1)NC2=CC=CC=C2)N)SC3=CC=C(C=C3)Cl

Isomeric SMILES

C[C@H](C(=O)OCC1=NC(=NC(=N1)NC2=CC=CC=C2)N)SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H18ClN5O2S/c1-12(28-15-9-7-13(20)8-10-15)17(26)27-11-16-23-18(21)25-19(24-16)22-14-5-3-2-4-6-14/h2-10,12H,11H2,1H3,(H3,21,22,23,24,25)/t12-/m1/s1