4-chloranyl-N-(4-fluorophenyl)-6-methoxy-7-(2-thiomorpholin-4-ylethoxy)quinazolin-2-amine

Systemtic Name: 4-chloranyl-N-(4-fluorophenyl)-6-methoxy-7-(2-thiomorpholin-4-ylethoxy)quinazolin-2-amine Openeye Name: 4-chloro-N-(4-fluorophenyl)-6-methoxy-7-(2-thiomorpholinoethoxy)quinazolin-2-amine CAS Name: 4-chloro-N-(4-fluorophenyl)-6-methoxy-7-(2-thiomorpholin-4-ylethoxy)-2-quinazolinamine IUPAC Name: 4-chloro-N-(4-fluorophenyl)-6-methoxy-7-(2-thiomorpholin-4-ylethoxy)quinazolin-2-amine Traditional Name: [4-chloro-6-methoxy-7-(2-thiomorpholinoethoxy)quinazolin-2-yl]-(4-fluorophenyl)amine Formula: C21H22ClFN4O2S MolecularWeight: 448.941383

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)NC3=CC=C(C=C3)F)Cl)OCCN4CCSCC4

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)NC3=CC=C(C=C3)F)Cl)OCCN4CCSCC4

InChI

InChI=1S/C21H22ClFN4O2S/c1-28-18-12-16-17(13-19(18)29-9-6-27-7-10-30-11-8-27)25-21(26-20(16)22)24-15-4-2-14(23)3-5-15/h2-5,12-13H,6-11H2,1H3,(H,24,25,26)