N-chloranyl-7-(3-ethylsulfonylpropoxy)-N-(2-fluorophenyl)-6-methoxy-quinazolin-4-amine

Systemtic Name: N-chloranyl-7-(3-ethylsulfonylpropoxy)-N-(2-fluorophenyl)-6-methoxy-quinazolin-4-amine Openeye Name: N-chloro-7-(3-ethylsulfonylpropoxy)-N-(2-fluorophenyl)-6-methoxy-quinazolin-4-amine CAS Name: N-chloro-7-(3-ethylsulfonylpropoxy)-N-(2-fluorophenyl)-6-methoxy-4-quinazolinamine IUPAC Name: N-chloro-7-(3-ethylsulfonylpropoxy)-N-(2-fluorophenyl)-6-methoxyquinazolin-4-amine Traditional Name: chloro-[7-(3-esylpropoxy)-6-methoxy-quinazolin-4-yl]-(2-fluorophenyl)amine Formula: C20H21ClFN3O4S MolecularWeight: 453.914843

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)CCCOC1=C(C=C2C(=C1)N=CN=C2N(C3=CC=CC=C3F)Cl)OC

Isomeric SMILES

CCS(=O)(=O)CCCOC1=C(C=C2C(=C1)N=CN=C2N(C3=CC=CC=C3F)Cl)OC

InChI

InChI=1S/C20H21ClFN3O4S/c1-3-30(26,27)10-6-9-29-19-12-16-14(11-18(19)28-2)20(24-13-23-16)25(21)17-8-5-4-7-15(17)22/h4-5,7-8,11-13H,3,6,9-10H2,1-2H3