N-ethyl-3-[6-[(4-fluoranylpiperidin-1-yl)methyl]-4-oxidanylidene-quinazolin-3-yl]-4-methyl-benzamide

Systemtic Name: N-ethyl-3-[6-[(4-fluoranylpiperidin-1-yl)methyl]-4-oxidanylidene-quinazolin-3-yl]-4-methyl-benzamide Openeye Name: N-ethyl-3-[6-[(4-fluoro-1-piperidyl)methyl]-4-oxo-quinazolin-3-yl]-4-methyl-benzamide CAS Name: N-ethyl-3-[6-[(4-fluoro-1-piperidinyl)methyl]-4-oxo-3-quinazolinyl]-4-methylbenzamide IUPAC Name: N-ethyl-3-[6-[(4-fluoropiperidin-1-yl)methyl]-4-oxoquinazolin-3-yl]-4-methylbenzamide Traditional Name: N-ethyl-3-[6-[(4-fluoropiperidino)methyl]-4-keto-quinazolin-3-yl]-4-methyl-benzamide Formula: C24H27FN4O2 MolecularWeight: 422.495183

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=C(C=C1)C)N2C=NC3=C(C2=O)C=C(C=C3)CN4CCC(CC4)F

Isomeric SMILES

CCNC(=O)C1=CC(=C(C=C1)C)N2C=NC3=C(C2=O)C=C(C=C3)CN4CCC(CC4)F

InChI

InChI=1S/C24H27FN4O2/c1-3-26-23(30)18-6-4-16(2)22(13-18)29-15-27-21-7-5-17(12-20(21)24(29)31)14-28-10-8-19(25)9-11-28/h4-7,12-13,15,19H,3,8-11,14H2,1-2H3,(H,26,30)