N-[4-(3-azanylpyrrolidin-1-yl)-3-fluoranyl-phenyl]-7-methoxy-8-propan-2-yl-quinazolin-2-amine

Systemtic Name: N-[4-(3-azanylpyrrolidin-1-yl)-3-fluoranyl-phenyl]-7-methoxy-8-propan-2-yl-quinazolin-2-amine Openeye Name: N-[4-(3-aminopyrrolidin-1-yl)-3-fluoro-phenyl]-8-isopropyl-7-methoxy-quinazolin-2-amine CAS Name: N-[4-(3-amino-1-pyrrolidinyl)-3-fluorophenyl]-7-methoxy-8-propan-2-yl-2-quinazolinamine IUPAC Name: N-[4-(3-aminopyrrolidin-1-yl)-3-fluorophenyl]-7-methoxy-8-propan-2-ylquinazolin-2-amine Traditional Name: [4-(3-aminopyrrolidino)-3-fluoro-phenyl]-(8-isopropyl-7-methoxy-quinazolin-2-yl)amine Formula: C22H26FN5O MolecularWeight: 395.473143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC2=CN=C(N=C21)NC3=CC(=C(C=C3)N4CCC(C4)N)F)OC

Isomeric SMILES

CC(C)C1=C(C=CC2=CN=C(N=C21)NC3=CC(=C(C=C3)N4CCC(C4)N)F)OC

InChI

InChI=1S/C22H26FN5O/c1-13(2)20-19(29-3)7-4-14-11-25-22(27-21(14)20)26-16-5-6-18(17(23)10-16)28-9-8-15(24)12-28/h4-7,10-11,13,15H,8-9,12,24H2,1-3H3,(H,25,26,27)