6,7-diethoxy-N-[2-fluoranyl-5-(2-methyl-1,3-thiazol-4-yl)phenyl]quinazolin-4-amine

Systemtic Name: 6,7-diethoxy-N-[2-fluoranyl-5-(2-methyl-1,3-thiazol-4-yl)phenyl]quinazolin-4-amine Openeye Name: 6,7-diethoxy-N-[2-fluoro-5-(2-methylthiazol-4-yl)phenyl]quinazolin-4-amine CAS Name: 6,7-diethoxy-N-[2-fluoro-5-(2-methyl-4-thiazolyl)phenyl]-4-quinazolinamine IUPAC Name: 6,7-diethoxy-N-[2-fluoro-5-(2-methyl-1,3-thiazol-4-yl)phenyl]quinazolin-4-amine Traditional Name: (6,7-diethoxyquinazolin-4-yl)-[2-fluoro-5-(2-methylthiazol-4-yl)phenyl]amine Formula: C22H21FN4O2S MolecularWeight: 424.491143

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=CC(=C3)C4=CSC(=N4)C)F)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=CC(=C3)C4=CSC(=N4)C)F)OCC

InChI

InChI=1S/C22H21FN4O2S/c1-4-28-20-9-15-17(10-21(20)29-5-2)24-12-25-22(15)27-18-8-14(6-7-16(18)23)19-11-30-13(3)26-19/h6-12H,4-5H2,1-3H3,(H,24,25,27)