2-[2-(6-bromanyl-2-methyl-4-oxidanylidene-quinazolin-3-yl)-3-(2-methyl-1H-indol-3-yl)-4-oxidanylidene-1,2-thiazolidin-5-yl]propanoic acid

Systemtic Name: 2-[2-(6-bromanyl-2-methyl-4-oxidanylidene-quinazolin-3-yl)-3-(2-methyl-1H-indol-3-yl)-4-oxidanylidene-1,2-thiazolidin-5-yl]propanoic acid Openeye Name: 2-[2-(6-bromo-2-methyl-4-oxo-quinazolin-3-yl)-3-(2-methyl-1H-indol-3-yl)-4-oxo-isothiazolidin-5-yl]propanoic acid CAS Name: 2-[2-(6-bromo-2-methyl-4-oxo-3-quinazolinyl)-3-(2-methyl-1H-indol-3-yl)-4-oxo-5-isothiazolidinyl]propanoic acid IUPAC Name: 2-[2-(6-bromo-2-methyl-4-oxoquinazolin-3-yl)-3-(2-methyl-1H-indol-3-yl)-4-oxo-1,2-thiazolidin-5-yl]propanoic acid Traditional Name: 2-[2-(6-bromo-4-keto-2-methyl-quinazolin-3-yl)-4-keto-3-(2-methyl-1H-indol-3-yl)isothiazolidin-5-yl]propionic acid Formula: C24H21BrN4O4S MolecularWeight: 541.41694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C3C(=O)C(SN3N4C(=NC5=C(C4=O)C=C(C=C5)Br)C)C(C)C(=O)O

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C3C(=O)C(SN3N4C(=NC5=C(C4=O)C=C(C=C5)Br)C)C(C)C(=O)O

InChI

InChI=1S/C24H21BrN4O4S/c1-11(24(32)33)22-21(30)20(19-12(2)26-17-7-5-4-6-15(17)19)29(34-22)28-13(3)27-18-9-8-14(25)10-16(18)23(28)31/h4-11,20,22,26H,1-3H3,(H,32,33)