6-azabicyclo[3.2.1]octan-6-yl-[1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidin-4-yl]methanone

Systemtic Name: 6-azabicyclo[3.2.1]octan-6-yl-[1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidin-4-yl]methanone Openeye Name: 6-azabicyclo[3.2.1]octan-6-yl-[1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)-4-piperidyl]methanone CAS Name: 6-azabicyclo[3.2.1]octan-6-yl-[1-(4-methyl-7-methylsulfonyl-2-quinazolinyl)-4-piperidinyl]methanone IUPAC Name: 6-azabicyclo[3.2.1]octan-6-yl-[1-(4-methyl-7-methylsulfonylquinazolin-2-yl)piperidin-4-yl]methanone Traditional Name: 6-azabicyclo[3.2.1]octan-6-yl-[1-(7-mesyl-4-methyl-quinazolin-2-yl)-4-piperidyl]methanone Formula: C23H30N4O3S MolecularWeight: 442.5743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C=CC(=C2)S(=O)(=O)C)N3CCC(CC3)C(=O)N4CC5CCCC4C5

Isomeric SMILES

CC1=NC(=NC2=C1C=CC(=C2)S(=O)(=O)C)N3CCC(CC3)C(=O)N4CC5CCCC4C5

InChI

InChI=1S/C23H30N4O3S/c1-15-20-7-6-19(31(2,29)30)13-21(20)25-23(24-15)26-10-8-17(9-11-26)22(28)27-14-16-4-3-5-18(27)12-16/h6-7,13,16-18H,3-5,8-12,14H2,1-2H3