(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 2-cyclohexylethanoate

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 2-cyclohexylethanoate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 2-cyclohexylacetate CAS Name: 2-cyclohexylacetic acid (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 2-cyclohexylacetate Traditional Name: 2-cyclohexylacetic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C18H23N5O2 MolecularWeight: 341.40752

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3)N

Isomeric SMILES

C1CCC(CC1)CC(=O)OCC2=NC(=NC(=N2)NC3=CC=CC=C3)N

InChI

InChI=1S/C18H23N5O2/c19-17-21-15(12-25-16(24)11-13-7-3-1-4-8-13)22-18(23-17)20-14-9-5-2-6-10-14/h2,5-6,9-10,13H,1,3-4,7-8,11-12H2,(H3,19,20,21,22,23)