(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl (2R,3S)-3-methyl-2-phenyl-pentanoate

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl (2R,3S)-3-methyl-2-phenyl-pentanoate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl (2R,3S)-3-methyl-2-phenyl-pentanoate CAS Name: (2R,3S)-3-methyl-2-phenylpentanoic 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,3S)-3-methyl-2-phenylpentanoate Traditional Name: (2R,3S)-3-methyl-2-phenyl-valeric acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C22H25N5O2 MolecularWeight: 391.4662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C1=CC=CC=C1)C(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3)N

Isomeric SMILES

CC[C@H](C)[C@H](C1=CC=CC=C1)C(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3)N

InChI

InChI=1S/C22H25N5O2/c1-3-15(2)19(16-10-6-4-7-11-16)20(28)29-14-18-25-21(23)27-22(26-18)24-17-12-8-5-9-13-17/h4-13,15,19H,3,14H2,1-2H3,(H3,23,24,25,26,27)/t15-,19+/m0/s1