methyl 3-(4-azanylquinazolin-6-yl)-2-[1-(4-phenylphenyl)carbonylpyrrolidin-2-yl]propanoate

Systemtic Name: methyl 3-(4-azanylquinazolin-6-yl)-2-[1-(4-phenylphenyl)carbonylpyrrolidin-2-yl]propanoate Openeye Name: methyl 3-(4-aminoquinazolin-6-yl)-2-[1-(4-phenylbenzoyl)pyrrolidin-2-yl]propanoate CAS Name: 3-(4-amino-6-quinazolinyl)-2-[1-[oxo-(4-phenylphenyl)methyl]-2-pyrrolidinyl]propanoic acid methyl ester IUPAC Name: methyl 3-(4-aminoquinazolin-6-yl)-2-[1-(4-phenylbenzoyl)pyrrolidin-2-yl]propanoate Traditional Name: 3-(4-aminoquinazolin-6-yl)-2-[1-(4-phenylbenzoyl)pyrrolidin-2-yl]propionic acid methyl ester Formula: C29H28N4O3 MolecularWeight: 480.55762

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC2=C(C=C1)N=CN=C2N)C3CCCN3C(=O)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C(CC1=CC2=C(C=C1)N=CN=C2N)C3CCCN3C(=O)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H28N4O3/c1-36-29(35)24(17-19-9-14-25-23(16-19)27(30)32-18-31-25)26-8-5-15-33(26)28(34)22-12-10-21(11-13-22)20-6-3-2-4-7-20/h2-4,6-7,9-14,16,18,24,26H,5,8,15,17H2,1H3,(H2,30,31,32)