methyl 1-[1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidin-3-yl]carbonylpiperidine-2-carboxylate

Systemtic Name: methyl 1-[1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidin-3-yl]carbonylpiperidine-2-carboxylate Openeye Name: methyl 1-[1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidine-3-carbonyl]piperidine-2-carboxylate CAS Name: 1-[[1-(4-methyl-7-methylsulfonyl-2-quinazolinyl)-3-piperidinyl]-oxomethyl]-2-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[1-(4-methyl-7-methylsulfonylquinazolin-2-yl)piperidine-3-carbonyl]piperidine-2-carboxylate Traditional Name: 1-[1-(7-mesyl-4-methyl-quinazolin-2-yl)nipecotoyl]pipecolinic acid methyl ester Formula: C23H30N4O5S MolecularWeight: 474.5731

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C=CC(=C2)S(=O)(=O)C)N3CCCC(C3)C(=O)N4CCCCC4C(=O)OC

Isomeric SMILES

CC1=NC(=NC2=C1C=CC(=C2)S(=O)(=O)C)N3CCCC(C3)C(=O)N4CCCCC4C(=O)OC

InChI

InChI=1S/C23H30N4O5S/c1-15-18-10-9-17(33(3,30)31)13-19(18)25-23(24-15)26-11-6-7-16(14-26)21(28)27-12-5-4-8-20(27)22(29)32-2/h9-10,13,16,20H,4-8,11-12,14H2,1-3H3