[4,6-bis(azanyl)-1,3,5-triazin-2-yl]methyl 4-propan-2-ylbenzoate

Systemtic Name: [4,6-bis(azanyl)-1,3,5-triazin-2-yl]methyl 4-propan-2-ylbenzoate Openeye Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl 4-isopropylbenzoate CAS Name: 4-propan-2-ylbenzoic acid (4,6-diamino-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl 4-propan-2-ylbenzoate Traditional Name: 4-isopropylbenzoic acid (4,6-diamino-s-triazin-2-yl)methyl ester Formula: C14H17N5O2 MolecularWeight: 287.31708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)OCC2=NC(=NC(=N2)N)N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)OCC2=NC(=NC(=N2)N)N

InChI

InChI=1S/C14H17N5O2/c1-8(2)9-3-5-10(6-4-9)12(20)21-7-11-17-13(15)19-14(16)18-11/h3-6,8H,7H2,1-2H3,(H4,15,16,17,18,19)