2-chloranyl-4-fluoranyl-5-[[6-methoxy-7-(2-thiomorpholin-4-ylethoxy)quinazolin-4-yl]amino]phenol

Systemtic Name: 2-chloranyl-4-fluoranyl-5-[[6-methoxy-7-(2-thiomorpholin-4-ylethoxy)quinazolin-4-yl]amino]phenol Openeye Name: 2-chloro-4-fluoro-5-[[6-methoxy-7-(2-thiomorpholinoethoxy)quinazolin-4-yl]amino]phenol CAS Name: 2-chloro-4-fluoro-5-[[6-methoxy-7-(2-thiomorpholin-4-ylethoxy)-4-quinazolinyl]amino]phenol IUPAC Name: 2-chloro-4-fluoro-5-[[6-methoxy-7-(2-thiomorpholin-4-ylethoxy)quinazolin-4-yl]amino]phenol Traditional Name: 2-chloro-4-fluoro-5-[[6-methoxy-7-(2-thiomorpholinoethoxy)quinazolin-4-yl]amino]phenol Formula: C21H22ClFN4O3S MolecularWeight: 464.940783

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=C(C=C3F)Cl)O)OCCN4CCSCC4

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=C(C=C3F)Cl)O)OCCN4CCSCC4

InChI

InChI=1S/C21H22ClFN4O3S/c1-29-19-8-13-16(11-20(19)30-5-2-27-3-6-31-7-4-27)24-12-25-21(13)26-17-10-18(28)14(22)9-15(17)23/h8-12,28H,2-7H2,1H3,(H,24,25,26)