2-[4-[4-(3,4-dihydro-1H-isoquinolin-2-yl)piperidin-1-yl]piperidin-1-yl]-7-fluoranyl-4,6-dimethyl-quinazoline

Systemtic Name: 2-[4-[4-(3,4-dihydro-1H-isoquinolin-2-yl)piperidin-1-yl]piperidin-1-yl]-7-fluoranyl-4,6-dimethyl-quinazoline Openeye Name: 2-[4-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-1-piperidyl]-1-piperidyl]-7-fluoro-4,6-dimethyl-quinazoline CAS Name: 2-[4-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-1-piperidinyl]-1-piperidinyl]-7-fluoro-4,6-dimethylquinazoline IUPAC Name: 2-[4-[4-(3,4-dihydro-1H-isoquinolin-2-yl)piperidin-1-yl]piperidin-1-yl]-7-fluoro-4,6-dimethylquinazoline Traditional Name: 2-[4-[4-(3,4-dihydro-1H-isoquinolin-2-yl)piperidino]piperidino]-7-fluoro-4,6-dimethyl-quinazoline Formula: C29H36FN5 MolecularWeight: 473.628043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC(CC3)N4CCC(CC4)N5CCC6=CC=CC=C6C5)C)F

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC(CC3)N4CCC(CC4)N5CCC6=CC=CC=C6C5)C)F

InChI

InChI=1S/C29H36FN5/c1-20-17-26-21(2)31-29(32-28(26)18-27(20)30)34-15-10-24(11-16-34)33-13-8-25(9-14-33)35-12-7-22-5-3-4-6-23(22)19-35/h3-6,17-18,24-25H,7-16,19H2,1-2H3