[4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 4-(pyrazol-1-ylmethyl)benzoate

Systemtic Name: [4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 4-(pyrazol-1-ylmethyl)benzoate Openeye Name: [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 4-(pyrazol-1-ylmethyl)benzoate CAS Name: 4-(1-pyrazolylmethyl)benzoic acid [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl ester IUPAC Name: [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 4-(pyrazol-1-ylmethyl)benzoate Traditional Name: 4-(pyrazol-1-ylmethyl)benzoic acid [4-amino-6-(dimethylamino)-s-triazin-2-yl]methyl ester Formula: C17H19N7O2 MolecularWeight: 353.37846

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC(=N1)N)COC(=O)C2=CC=C(C=C2)CN3C=CC=N3

Isomeric SMILES

CN(C)C1=NC(=NC(=N1)N)COC(=O)C2=CC=C(C=C2)CN3C=CC=N3

InChI

InChI=1S/C17H19N7O2/c1-23(2)17-21-14(20-16(18)22-17)11-26-15(25)13-6-4-12(5-7-13)10-24-9-3-8-19-24/h3-9H,10-11H2,1-2H3,(H2,18,20,21,22)