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

Systemtic Name: methyl (2S)-3-(1H-indol-3-yl)-2-(4-oxidanylidene-2-propan-2-yl-quinazolin-3-yl)propanoate Openeye Name: methyl (2S)-3-(1H-indol-3-yl)-2-(2-isopropyl-4-oxo-quinazolin-3-yl)propanoate CAS Name: (2S)-3-(1H-indol-3-yl)-2-(4-oxo-2-propan-2-yl-3-quinazolinyl)propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(1H-indol-3-yl)-2-(4-oxo-2-propan-2-ylquinazolin-3-yl)propanoate Traditional Name: (2S)-3-(1H-indol-3-yl)-2-(2-isopropyl-4-keto-quinazolin-3-yl)propionic acid methyl ester Formula: C23H23N3O3 MolecularWeight: 389.44702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23N3O3/c1-14(2)21-25-19-11-7-5-9-17(19)22(27)26(21)20(23(28)29-3)12-15-13-24-18-10-6-4-8-16(15)18/h4-11,13-14,20,24H,12H2,1-3H3/t20-/m0/s1