1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl 3-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoate

Systemtic Name: 1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl 3-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoate Openeye Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl 3-[(3,5-dimethyl-1-piperidyl)sulfonyl]benzoate CAS Name: 3-[(3,5-dimethyl-1-piperidinyl)sulfonyl]benzoic acid 1-(4-oxo-1H-quinazolin-2-yl)ethyl ester IUPAC Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl 3-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 3-(3,5-dimethylpiperidino)sulfonylbenzoic acid 1-(4-keto-1H-quinazolin-2-yl)ethyl ester Formula: C24H27N3O5S MolecularWeight: 469.55328

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC(C)C3=NC(=O)C4=CC=CC=C4N3)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC(C)C3=NC(=O)C4=CC=CC=C4N3)C

InChI

InChI=1S/C24H27N3O5S/c1-15-11-16(2)14-27(13-15)33(30,31)19-8-6-7-18(12-19)24(29)32-17(3)22-25-21-10-5-4-9-20(21)23(28)26-22/h4-10,12,15-17H,11,13-14H2,1-3H3,(H,25,26,28)