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

Systemtic Name: ethyl (2R)-1-[(3S)-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidin-3-yl]carbonylpiperidine-2-carboxylate Openeye Name: ethyl (2R)-1-[(3S)-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidine-3-carbonyl]piperidine-2-carboxylate CAS Name: (2R)-1-[[(3S)-1-(4-methyl-7-methylsulfonyl-2-quinazolinyl)-3-piperidinyl]-oxomethyl]-2-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2R)-1-[(3S)-1-(4-methyl-7-methylsulfonylquinazolin-2-yl)piperidine-3-carbonyl]piperidine-2-carboxylate Traditional Name: (2R)-1-[(3S)-1-(7-mesyl-4-methyl-quinazolin-2-yl)nipecotoyl]pipecolinic acid ethyl ester Formula: C24H32N4O5S MolecularWeight: 488.59968

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCCN1C(=O)C2CCCN(C2)C3=NC4=C(C=CC(=C4)S(=O)(=O)C)C(=N3)C

Isomeric SMILES

CCOC(=O)[C@H]1CCCCN1C(=O)[C@H]2CCCN(C2)C3=NC4=C(C=CC(=C4)S(=O)(=O)C)C(=N3)C

InChI

InChI=1S/C24H32N4O5S/c1-4-33-23(30)21-9-5-6-13-28(21)22(29)17-8-7-12-27(15-17)24-25-16(2)19-11-10-18(34(3,31)32)14-20(19)26-24/h10-11,14,17,21H,4-9,12-13,15H2,1-3H3/t17-,21+/m0/s1