(4-azanylquinazolin-2-yl)methyl 4-(1,2,4-triazol-1-yl)benzoate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl 4-(1,2,4-triazol-1-yl)benzoate Openeye Name: (4-aminoquinazolin-2-yl)methyl 4-(1,2,4-triazol-1-yl)benzoate CAS Name: 4-(1,2,4-triazol-1-yl)benzoic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl 4-(1,2,4-triazol-1-yl)benzoate Traditional Name: 4-(1,2,4-triazol-1-yl)benzoic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C18H14N6O2 MolecularWeight: 346.34276

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)COC(=O)C3=CC=C(C=C3)N4C=NC=N4)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)COC(=O)C3=CC=C(C=C3)N4C=NC=N4)N

InChI

InChI=1S/C18H14N6O2/c19-17-14-3-1-2-4-15(14)22-16(23-17)9-26-18(25)12-5-7-13(8-6-12)24-11-20-10-21-24/h1-8,10-11H,9H2,(H2,19,22,23)