(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 2-[(3-fluorophenyl)carbonylamino]ethanoate

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 2-[(3-fluorophenyl)carbonylamino]ethanoate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 2-[(3-fluorobenzoyl)amino]acetate CAS Name: 2-[[(3-fluorophenyl)-oxomethyl]amino]acetic 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-[(3-fluorobenzoyl)amino]acetate Traditional Name: 2-[(3-fluorobenzoyl)amino]acetic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C19H17FN6O3 MolecularWeight: 396.375083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)CNC(=O)C3=CC(=CC=C3)F

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)CNC(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C19H17FN6O3/c20-13-6-4-5-12(9-13)17(28)22-10-16(27)29-11-15-24-18(21)26-19(25-15)23-14-7-2-1-3-8-14/h1-9H,10-11H2,(H,22,28)(H3,21,23,24,25,26)