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

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 2-(4-bromophenyl)ethanoate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 2-(4-bromophenyl)acetate CAS Name: 2-(4-bromophenyl)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-(4-bromophenyl)acetate Traditional Name: 2-(4-bromophenyl)acetic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C18H16BrN5O2 MolecularWeight: 414.25594

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)CC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H16BrN5O2/c19-13-8-6-12(7-9-13)10-16(25)26-11-15-22-17(20)24-18(23-15)21-14-4-2-1-3-5-14/h1-9H,10-11H2,(H3,20,21,22,23,24)