(4-azanylquinazolin-2-yl)methyl 3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]propanoate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl 3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]propanoate Openeye Name: (4-aminoquinazolin-2-yl)methyl 3-[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]propanoate CAS Name: 3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]propanoic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl 3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]propanoate Traditional Name: 3-[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]propionic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C21H19N5O3 MolecularWeight: 389.40726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=N2)CCC(=O)OCC3=NC4=CC=CC=C4C(=N3)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=N2)CCC(=O)OCC3=NC4=CC=CC=C4C(=N3)N

InChI

InChI=1S/C21H19N5O3/c1-13-6-8-14(9-7-13)21-25-18(29-26-21)10-11-19(27)28-12-17-23-16-5-3-2-4-15(16)20(22)24-17/h2-9H,10-12H2,1H3,(H2,22,23,24)