[1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidin-4-yl]-[(3R)-3-phenylpiperidin-1-yl]methanone

Systemtic Name: [1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidin-4-yl]-[(3R)-3-phenylpiperidin-1-yl]methanone Openeye Name: [1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)-4-piperidyl]-[(3R)-3-phenyl-1-piperidyl]methanone CAS Name: [1-(4-methyl-7-methylsulfonyl-2-quinazolinyl)-4-piperidinyl]-[(3R)-3-phenyl-1-piperidinyl]methanone IUPAC Name: [1-(4-methyl-7-methylsulfonylquinazolin-2-yl)piperidin-4-yl]-[(3R)-3-phenylpiperidin-1-yl]methanone Traditional Name: [1-(7-mesyl-4-methyl-quinazolin-2-yl)-4-piperidyl]-[(3R)-3-phenylpiperidino]methanone Formula: C27H32N4O3S MolecularWeight: 492.63298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C=CC(=C2)S(=O)(=O)C)N3CCC(CC3)C(=O)N4CCCC(C4)C5=CC=CC=C5

Isomeric SMILES

CC1=NC(=NC2=C1C=CC(=C2)S(=O)(=O)C)N3CCC(CC3)C(=O)N4CCC[C@@H](C4)C5=CC=CC=C5

InChI

InChI=1S/C27H32N4O3S/c1-19-24-11-10-23(35(2,33)34)17-25(24)29-27(28-19)30-15-12-21(13-16-30)26(32)31-14-6-9-22(18-31)20-7-4-3-5-8-20/h3-5,7-8,10-11,17,21-22H,6,9,12-16,18H2,1-2H3/t22-/m0/s1