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

Systemtic Name: 4-[1-(6-azanyl-4-morpholin-4-yl-quinazolin-2-yl)-5-chloranyl-indol-3-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[1-(6-amino-4-morpholino-quinazolin-2-yl)-5-chloro-indol-3-yl]-4-oxo-butanoic acid CAS Name: 4-[1-[6-amino-4-(4-morpholinyl)-2-quinazolinyl]-5-chloro-3-indolyl]-4-oxobutanoic acid IUPAC Name: 4-[1-(6-amino-4-morpholin-4-ylquinazolin-2-yl)-5-chloroindol-3-yl]-4-oxobutanoic acid Traditional Name: 4-[1-(6-amino-4-morpholino-quinazolin-2-yl)-5-chloro-indol-3-yl]-4-keto-butyric acid Formula: C24H22ClN5O4 MolecularWeight: 479.91558

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=NC3=C2C=C(C=C3)N)N4C=C(C5=C4C=CC(=C5)Cl)C(=O)CCC(=O)O

Isomeric SMILES

C1COCCN1C2=NC(=NC3=C2C=C(C=C3)N)N4C=C(C5=C4C=CC(=C5)Cl)C(=O)CCC(=O)O

InChI

InChI=1S/C24H22ClN5O4/c25-14-1-4-20-16(11-14)18(21(31)5-6-22(32)33)13-30(20)24-27-19-3-2-15(26)12-17(19)23(28-24)29-7-9-34-10-8-29/h1-4,11-13H,5-10,26H2,(H,32,33)