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

Systemtic Name: methyl (2S)-3-(1H-indol-3-yl)-2-(2-methyl-4-oxidanylidene-quinazolin-3-yl)propanoate Openeye Name: methyl (2S)-3-(1H-indol-3-yl)-2-(2-methyl-4-oxo-quinazolin-3-yl)propanoate CAS Name: (2S)-3-(1H-indol-3-yl)-2-(2-methyl-4-oxo-3-quinazolinyl)propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(1H-indol-3-yl)-2-(2-methyl-4-oxoquinazolin-3-yl)propanoate Traditional Name: (2S)-3-(1H-indol-3-yl)-2-(4-keto-2-methyl-quinazolin-3-yl)propionic acid methyl ester Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1C(CC3=CNC4=CC=CC=C43)C(=O)OC

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1[C@@H](CC3=CNC4=CC=CC=C43)C(=O)OC

InChI

InChI=1S/C21H19N3O3/c1-13-23-18-10-6-4-8-16(18)20(25)24(13)19(21(26)27-2)11-14-12-22-17-9-5-3-7-15(14)17/h3-10,12,19,22H,11H2,1-2H3/t19-/m0/s1