2-imidazol-1-yl-N-(2-phenoxyethyl)quinazolin-4-amine; methanesulfonic acid

Systemtic Name: 2-imidazol-1-yl-N-(2-phenoxyethyl)quinazolin-4-amine; methanesulfonic acid Openeye Name: 2-imidazol-1-yl-N-(2-phenoxyethyl)quinazolin-4-amine; methanesulfonic acid CAS Name: 2-(1-imidazolyl)-N-(2-phenoxyethyl)-4-quinazolinamine; methanesulfonic acid IUPAC Name: 2-imidazol-1-yl-N-(2-phenoxyethyl)quinazolin-4-amine; methanesulfonic acid Traditional Name: (2-imidazol-1-ylquinazolin-4-yl)-(2-phenoxyethyl)amine; mesylic acid Formula: C21H25N5O7S2 MolecularWeight: 523.5825

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)O.CS(=O)(=O)O.C1=CC=C(C=C1)OCCNC2=NC(=NC3=CC=CC=C32)N4C=CN=C4

Isomeric SMILES

CS(=O)(=O)O.CS(=O)(=O)O.C1=CC=C(C=C1)OCCNC2=NC(=NC3=CC=CC=C32)N4C=CN=C4

InChI

InChI=1S/C19H17N5O.2CH4O3S/c1-2-6-15(7-3-1)25-13-11-21-18-16-8-4-5-9-17(16)22-19(23-18)24-12-10-20-14-24;2*1-5(2,3)4/h1-10,12,14H,11,13H2,(H,21,22,23);2*1H3,(H,2,3,4)