1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl 4-(4-methylpiperidin-1-yl)sulfonylbenzoate

Systemtic Name: 1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl 4-(4-methylpiperidin-1-yl)sulfonylbenzoate Openeye Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl 4-[(4-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 4-[(4-methyl-1-piperidinyl)sulfonyl]benzoic acid 1-(4-oxo-1H-quinazolin-2-yl)ethyl ester IUPAC Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl 4-(4-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 4-(4-methylpiperidino)sulfonylbenzoic acid 1-(4-keto-1H-quinazolin-2-yl)ethyl ester Formula: C23H25N3O5S MolecularWeight: 455.5267

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC(C)C3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC(C)C3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C23H25N3O5S/c1-15-11-13-26(14-12-15)32(29,30)18-9-7-17(8-10-18)23(28)31-16(2)21-24-20-6-4-3-5-19(20)22(27)25-21/h3-10,15-16H,11-14H2,1-2H3,(H,24,25,27)