tert-butyl 4-(7-methoxy-6-methylsulfonyloxy-quinazolin-4-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(7-methoxy-6-methylsulfonyloxy-quinazolin-4-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(7-methoxy-6-methylsulfonyloxy-quinazolin-4-yl)piperazine-1-carboxylate CAS Name: 4-(7-methoxy-6-methylsulfonyloxy-4-quinazolinyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(7-methoxy-6-methylsulfonyloxyquinazolin-4-yl)piperazine-1-carboxylate Traditional Name: 4-(7-methoxy-6-methylsulfonyloxy-quinazolin-4-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C19H26N4O6S MolecularWeight: 438.49794

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC=NC3=CC(=C(C=C32)OS(=O)(=O)C)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC=NC3=CC(=C(C=C32)OS(=O)(=O)C)OC

InChI

InChI=1S/C19H26N4O6S/c1-19(2,3)28-18(24)23-8-6-22(7-9-23)17-13-10-16(29-30(5,25)26)15(27-4)11-14(13)20-12-21-17/h10-12H,6-9H2,1-5H3