ethyl 1-[1,3-dimethyl-2,4-bis(oxidanylidene)quinazolin-6-yl]sulfonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[1,3-dimethyl-2,4-bis(oxidanylidene)quinazolin-6-yl]sulfonylpiperidine-3-carboxylate Openeye Name: ethyl 1-(1,3-dimethyl-2,4-dioxo-quinazolin-6-yl)sulfonylpiperidine-3-carboxylate CAS Name: 1-[(1,3-dimethyl-2,4-dioxo-6-quinazolinyl)sulfonyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(1,3-dimethyl-2,4-dioxoquinazolin-6-yl)sulfonylpiperidine-3-carboxylate Traditional Name: 1-(2,4-diketo-1,3-dimethyl-quinazolin-6-yl)sulfonylnipecotic acid ethyl ester Formula: C18H23N3O6S MolecularWeight: 409.45672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)N(C3=O)C)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)N(C3=O)C)C

InChI

InChI=1S/C18H23N3O6S/c1-4-27-17(23)12-6-5-9-21(11-12)28(25,26)13-7-8-15-14(10-13)16(22)20(3)18(24)19(15)2/h7-8,10,12H,4-6,9,11H2,1-3H3