N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-6-fluoranyl-7-piperazin-1-yl-quinazolin-2-amine

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-6-fluoranyl-7-piperazin-1-yl-quinazolin-2-amine Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-6-fluoro-7-piperazin-1-yl-quinazolin-2-amine CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-6-fluoro-7-(1-piperazinyl)-2-quinazolinamine IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-6-fluoro-7-piperazin-1-ylquinazolin-2-amine Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-(6-fluoro-7-piperazino-quinazolin-2-yl)amine Formula: C21H22FN5O2 MolecularWeight: 395.430083

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C3C=NC(=NC3=C2)NCC4=CC5=C(C=C4)OCCO5)F

Isomeric SMILES

C1CN(CCN1)C2=C(C=C3C=NC(=NC3=C2)NCC4=CC5=C(C=C4)OCCO5)F

InChI

InChI=1S/C21H22FN5O2/c22-16-10-15-13-25-21(26-17(15)11-18(16)27-5-3-23-4-6-27)24-12-14-1-2-19-20(9-14)29-8-7-28-19/h1-2,9-11,13,23H,3-8,12H2,(H,24,25,26)