1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl 3-(4-piperidin-1-ylsulfonylphenyl)propanoate

Systemtic Name: 1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl 3-(4-piperidin-1-ylsulfonylphenyl)propanoate Openeye Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl 3-[4-(1-piperidylsulfonyl)phenyl]propanoate CAS Name: 3-[4-(1-piperidinylsulfonyl)phenyl]propanoic acid 1-(4-oxo-1H-quinazolin-2-yl)ethyl ester IUPAC Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl 3-(4-piperidin-1-ylsulfonylphenyl)propanoate Traditional Name: 3-(4-piperidinosulfonylphenyl)propionic 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:

CC(C1=NC(=O)C2=CC=CC=C2N1)OC(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC(C1=NC(=O)C2=CC=CC=C2N1)OC(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C24H27N3O5S/c1-17(23-25-21-8-4-3-7-20(21)24(29)26-23)32-22(28)14-11-18-9-12-19(13-10-18)33(30,31)27-15-5-2-6-16-27/h3-4,7-10,12-13,17H,2,5-6,11,14-16H2,1H3,(H,25,26,29)