methyl (2S)-2-(2-tert-butyl-4-oxidanylidene-quinazolin-3-yl)-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl (2S)-2-(2-tert-butyl-4-oxidanylidene-quinazolin-3-yl)-3-(1H-indol-3-yl)propanoate Openeye Name: methyl (2S)-2-(2-tert-butyl-4-oxo-quinazolin-3-yl)-3-(1H-indol-3-yl)propanoate CAS Name: (2S)-2-(2-tert-butyl-4-oxo-3-quinazolinyl)-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-(2-tert-butyl-4-oxoquinazolin-3-yl)-3-(1H-indol-3-yl)propanoate Traditional Name: (2S)-2-(2-tert-butyl-4-keto-quinazolin-3-yl)-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C24H25N3O3 MolecularWeight: 403.4736

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=CC=CC=C2C(=O)N1C(CC3=CNC4=CC=CC=C43)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=NC2=CC=CC=C2C(=O)N1[C@@H](CC3=CNC4=CC=CC=C43)C(=O)OC

InChI

InChI=1S/C24H25N3O3/c1-24(2,3)23-26-19-12-8-6-10-17(19)21(28)27(23)20(22(29)30-4)13-15-14-25-18-11-7-5-9-16(15)18/h5-12,14,20,25H,13H2,1-4H3/t20-/m0/s1