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

Systemtic Name: [4-azanyl-6-[(4-methylphenyl)amino]-1,3,5-triazin-2-yl]methyl 3-cyclohexylpropanoate Openeye Name: [4-amino-6-(4-methylanilino)-1,3,5-triazin-2-yl]methyl 3-cyclohexylpropanoate CAS Name: 3-cyclohexylpropanoic acid [4-amino-6-(4-methylanilino)-1,3,5-triazin-2-yl]methyl ester IUPAC Name: [4-amino-6-(4-methylanilino)-1,3,5-triazin-2-yl]methyl 3-cyclohexylpropanoate Traditional Name: 3-cyclohexylpropionic acid [4-amino-6-(p-toluidino)-s-triazin-2-yl]methyl ester Formula: C20H27N5O2 MolecularWeight: 369.46068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)CCC3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)CCC3CCCCC3

InChI

InChI=1S/C20H27N5O2/c1-14-7-10-16(11-8-14)22-20-24-17(23-19(21)25-20)13-27-18(26)12-9-15-5-3-2-4-6-15/h7-8,10-11,15H,2-6,9,12-13H2,1H3,(H3,21,22,23,24,25)