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

Systemtic Name: ethyl 1-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methyl]piperidine-3-carboxylate CAS Name: 1-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methyl]piperidine-3-carboxylate Traditional Name: 1-[(4-amino-6-anilino-s-triazin-2-yl)methyl]nipecotic acid ethyl ester Formula: C18H24N6O2 MolecularWeight: 356.42216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CC2=NC(=NC(=N2)NC3=CC=CC=C3)N

Isomeric SMILES

CCOC(=O)C1CCCN(C1)CC2=NC(=NC(=N2)NC3=CC=CC=C3)N

InChI

InChI=1S/C18H24N6O2/c1-2-26-16(25)13-7-6-10-24(11-13)12-15-21-17(19)23-18(22-15)20-14-8-4-3-5-9-14/h3-5,8-9,13H,2,6-7,10-12H2,1H3,(H3,19,20,21,22,23)