2-[(2R)-1-(3-chlorophenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-(3-morpholin-4-ium-4-ylpropyl)quinazolin-4-one

Systemtic Name: 2-[(2R)-1-(3-chlorophenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-(3-morpholin-4-ium-4-ylpropyl)quinazolin-4-one Openeye Name: 2-[(1R)-2-(3-chlorophenyl)-1-methyl-2-oxo-ethyl]sulfanyl-3-(3-morpholin-4-ium-4-ylpropyl)quinazolin-4-one CAS Name: 2-[[(2R)-1-(3-chlorophenyl)-1-oxopropan-2-yl]thio]-3-[3-(4-morpholin-4-iumyl)propyl]-4-quinazolinone IUPAC Name: 2-[(2R)-1-(3-chlorophenyl)-1-oxopropan-2-yl]sulfanyl-3-(3-morpholin-4-ium-4-ylpropyl)quinazolin-4-one Traditional Name: 2-[[(1R)-2-(3-chlorophenyl)-2-keto-1-methyl-ethyl]thio]-3-(3-morpholin-4-ium-4-ylpropyl)quinazolin-4-one Formula: C24H27ClN3O3S+ MolecularWeight: 473.00748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC(=CC=C1)Cl)SC2=NC3=CC=CC=C3C(=O)N2CCC[NH+]4CCOCC4

Isomeric SMILES

C[C@H](C(=O)C1=CC(=CC=C1)Cl)SC2=NC3=CC=CC=C3C(=O)N2CCC[NH+]4CCOCC4

InChI

InChI=1S/C24H26ClN3O3S/c1-17(22(29)18-6-4-7-19(25)16-18)32-24-26-21-9-3-2-8-20(21)23(30)28(24)11-5-10-27-12-14-31-15-13-27/h2-4,6-9,16-17H,5,10-15H2,1H3/p+1/t17-/m1/s1