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

Systemtic Name: N-chloranyl-7-(3-ethylsulfanylpropoxy)-N-(2-fluorophenyl)-6-methoxy-quinazolin-4-amine Openeye Name: N-chloro-7-(3-ethylsulfanylpropoxy)-N-(2-fluorophenyl)-6-methoxy-quinazolin-4-amine CAS Name: N-chloro-7-[3-(ethylthio)propoxy]-N-(2-fluorophenyl)-6-methoxy-4-quinazolinamine IUPAC Name: N-chloro-7-(3-ethylsulfanylpropoxy)-N-(2-fluorophenyl)-6-methoxyquinazolin-4-amine Traditional Name: chloro-[7-[3-(ethylthio)propoxy]-6-methoxy-quinazolin-4-yl]-(2-fluorophenyl)amine Formula: C20H21ClFN3O2S MolecularWeight: 421.916043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSCCCOC1=C(C=C2C(=C1)N=CN=C2N(C3=CC=CC=C3F)Cl)OC

Isomeric SMILES

CCSCCCOC1=C(C=C2C(=C1)N=CN=C2N(C3=CC=CC=C3F)Cl)OC

InChI

InChI=1S/C20H21ClFN3O2S/c1-3-28-10-6-9-27-19-12-16-14(11-18(19)26-2)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