4-(6-chloranyl-5-fluoranyl-2,3-dihydroindol-1-yl)-6,7-dimethoxy-quinazoline; methanesulfonate

Systemtic Name: 4-(6-chloranyl-5-fluoranyl-2,3-dihydroindol-1-yl)-6,7-dimethoxy-quinazoline; methanesulfonate Openeye Name: 4-(6-chloro-5-fluoro-indolin-1-yl)-6,7-dimethoxy-quinazoline; methanesulfonate CAS Name: 4-(6-chloro-5-fluoro-2,3-dihydroindol-1-yl)-6,7-dimethoxyquinazoline; methanesulfonate IUPAC Name: 4-(6-chloro-5-fluoro-2,3-dihydroindol-1-yl)-6,7-dimethoxyquinazoline; methanesulfonate Traditional Name: 4-(6-chloro-5-fluoro-indolin-1-yl)-6,7-dimethoxy-quinazoline mesylate Formula: C19H18ClFN3O5S- MolecularWeight: 454.879723

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCC4=CC(=C(C=C43)Cl)F)OC.CS(=O)(=O)[O-]

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCC4=CC(=C(C=C43)Cl)F)OC.CS(=O)(=O)[O-]

InChI

InChI=1S/C18H15ClFN3O2.CH4O3S/c1-24-16-6-11-14(8-17(16)25-2)21-9-22-18(11)23-4-3-10-5-13(20)12(19)7-15(10)23;1-5(2,3)4/h5-9H,3-4H2,1-2H3;1H3,(H,2,3,4)/p-1