N-(1,3-benzodioxol-5-ylmethyl)-6-fluoranyl-7-piperazin-1-yl-quinazolin-4-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-6-fluoranyl-7-piperazin-1-yl-quinazolin-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-6-fluoro-7-piperazin-1-yl-quinazolin-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-6-fluoro-7-(1-piperazinyl)-4-quinazolinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-6-fluoro-7-piperazin-1-ylquinazolin-4-amine Traditional Name: (6-fluoro-7-piperazino-quinazolin-4-yl)-piperonyl-amine Formula: C20H20FN5O2 MolecularWeight: 381.403503

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C3C(=C2)N=CN=C3NCC4=CC5=C(C=C4)OCO5)F

Isomeric SMILES

C1CN(CCN1)C2=C(C=C3C(=C2)N=CN=C3NCC4=CC5=C(C=C4)OCO5)F

InChI

InChI=1S/C20H20FN5O2/c21-15-8-14-16(9-17(15)26-5-3-22-4-6-26)24-11-25-20(14)23-10-13-1-2-18-19(7-13)28-12-27-18/h1-2,7-9,11,22H,3-6,10,12H2,(H,23,24,25)