4-(6-chloranyl-2,3-dihydroindol-1-yl)-6-methoxy-7-(2-methoxyethoxy)quinazoline; methanesulfonate

Systemtic Name: 4-(6-chloranyl-2,3-dihydroindol-1-yl)-6-methoxy-7-(2-methoxyethoxy)quinazoline; methanesulfonate Openeye Name: 4-(6-chloroindolin-1-yl)-6-methoxy-7-(2-methoxyethoxy)quinazoline; methanesulfonate CAS Name: 4-(6-chloro-2,3-dihydroindol-1-yl)-6-methoxy-7-(2-methoxyethoxy)quinazoline; methanesulfonate IUPAC Name: 4-(6-chloro-2,3-dihydroindol-1-yl)-6-methoxy-7-(2-methoxyethoxy)quinazoline; methanesulfonate Traditional Name: 4-(6-chloroindolin-1-yl)-6-methoxy-7-(2-methoxyethoxy)quinazoline mesylate Formula: C21H23ClN3O6S- MolecularWeight: 480.94182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C2C(=C1)N=CN=C2N3CCC4=C3C=C(C=C4)Cl)OC.CS(=O)(=O)[O-]

Isomeric SMILES

COCCOC1=C(C=C2C(=C1)N=CN=C2N3CCC4=C3C=C(C=C4)Cl)OC.CS(=O)(=O)[O-]

InChI

InChI=1S/C20H20ClN3O3.CH4O3S/c1-25-7-8-27-19-11-16-15(10-18(19)26-2)20(23-12-22-16)24-6-5-13-3-4-14(21)9-17(13)24;1-5(2,3)4/h3-4,9-12H,5-8H2,1-2H3;1H3,(H,2,3,4)/p-1