ethyl 4-[(1R)-1-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)ethyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(1R)-1-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)ethyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(1R)-1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethyl]piperazine-1-carboxylate CAS Name: 4-[(1R)-1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(1R)-1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethyl]piperazine-1-carboxylate Traditional Name: 4-[(1R)-1-(4-amino-6-anilino-s-triazin-2-yl)ethyl]piperazine-1-carboxylic acid ethyl ester Formula: C18H25N7O2 MolecularWeight: 371.4368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(C)C2=NC(=NC(=N2)NC3=CC=CC=C3)N

Isomeric SMILES

CCOC(=O)N1CCN(CC1)[C@H](C)C2=NC(=NC(=N2)NC3=CC=CC=C3)N

InChI

InChI=1S/C18H25N7O2/c1-3-27-18(26)25-11-9-24(10-12-25)13(2)15-21-16(19)23-17(22-15)20-14-7-5-4-6-8-14/h4-8,13H,3,9-12H2,1-2H3,(H3,19,20,21,22,23)/t13-/m1/s1