4-[5-bromanyl-1-[6-(furan-2-yl)-4-morpholin-4-yl-quinazolin-2-yl]indol-3-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[5-bromanyl-1-[6-(furan-2-yl)-4-morpholin-4-yl-quinazolin-2-yl]indol-3-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[5-bromo-1-[6-(2-furyl)-4-morpholino-quinazolin-2-yl]indol-3-yl]-4-oxo-butanoic acid CAS Name: 4-[5-bromo-1-[6-(2-furanyl)-4-(4-morpholinyl)-2-quinazolinyl]-3-indolyl]-4-oxobutanoic acid IUPAC Name: 4-[5-bromo-1-[6-(furan-2-yl)-4-morpholin-4-ylquinazolin-2-yl]indol-3-yl]-4-oxobutanoic acid Traditional Name: 4-[5-bromo-1-[6-(2-furyl)-4-morpholino-quinazolin-2-yl]indol-3-yl]-4-keto-butyric acid Formula: C28H23BrN4O5 MolecularWeight: 575.41002

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=NC3=C2C=C(C=C3)C4=CC=CO4)N5C=C(C6=C5C=CC(=C6)Br)C(=O)CCC(=O)O

Isomeric SMILES

C1COCCN1C2=NC(=NC3=C2C=C(C=C3)C4=CC=CO4)N5C=C(C6=C5C=CC(=C6)Br)C(=O)CCC(=O)O

InChI

InChI=1S/C28H23BrN4O5/c29-18-4-6-23-19(15-18)21(24(34)7-8-26(35)36)16-33(23)28-30-22-5-3-17(25-2-1-11-38-25)14-20(22)27(31-28)32-9-12-37-13-10-32/h1-6,11,14-16H,7-10,12-13H2,(H,35,36)