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

Systemtic Name: ethyl 1-[[4-azanyl-6-[(4-methylphenyl)amino]-1,3,5-triazin-2-yl]methyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[[4-amino-6-(4-methylanilino)-1,3,5-triazin-2-yl]methyl]piperidine-3-carboxylate CAS Name: 1-[[4-amino-6-(4-methylanilino)-1,3,5-triazin-2-yl]methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[4-amino-6-(4-methylanilino)-1,3,5-triazin-2-yl]methyl]piperidine-3-carboxylate Traditional Name: 1-[[4-amino-6-(p-toluidino)-s-triazin-2-yl]methyl]nipecotic acid ethyl ester Formula: C19H26N6O2 MolecularWeight: 370.44874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N6O2/c1-3-27-17(26)14-5-4-10-25(11-14)12-16-22-18(20)24-19(23-16)21-15-8-6-13(2)7-9-15/h6-9,14H,3-5,10-12H2,1-2H3,(H3,20,21,22,23,24)