N-[4-(6-fluoranyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-2-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-(6-fluoranyl-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-2-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-(6-fluoro-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-2-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-(6-fluoro-3,4-dihydro-2H-quinolin-1-yl)-2-pyrimidinyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-(6-fluoro-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-2-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-(6-fluoro-3,4-dihydro-2H-quinolin-1-yl)pyrimidin-2-yl]-piperonylamide Formula: C21H17FN4O3 MolecularWeight: 392.383083

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)F)N(C1)C3=NC(=NC=C3)NC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CC2=C(C=CC(=C2)F)N(C1)C3=NC(=NC=C3)NC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H17FN4O3/c22-15-4-5-16-13(10-15)2-1-9-26(16)19-7-8-23-21(24-19)25-20(27)14-3-6-17-18(11-14)29-12-28-17/h3-8,10-11H,1-2,9,12H2,(H,23,24,25,27)