6-bromanyl-2-(2-morpholin-4-ium-4-ylethylsulfanyl)-3-phenyl-quinazolin-4-one

Systemtic Name: 6-bromanyl-2-(2-morpholin-4-ium-4-ylethylsulfanyl)-3-phenyl-quinazolin-4-one Openeye Name: 6-bromo-2-(2-morpholin-4-ium-4-ylethylsulfanyl)-3-phenyl-quinazolin-4-one CAS Name: 6-bromo-2-[2-(4-morpholin-4-iumyl)ethylthio]-3-phenyl-4-quinazolinone IUPAC Name: 6-bromo-2-(2-morpholin-4-ium-4-ylethylsulfanyl)-3-phenylquinazolin-4-one Traditional Name: 6-bromo-2-(2-morpholin-4-ium-4-ylethylthio)-3-phenyl-quinazolin-4-one Formula: C20H21BrN3O2S+ MolecularWeight: 447.36864

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCSC2=NC3=C(C=C(C=C3)Br)C(=O)N2C4=CC=CC=C4

Isomeric SMILES

C1COCC[NH+]1CCSC2=NC3=C(C=C(C=C3)Br)C(=O)N2C4=CC=CC=C4

InChI

InChI=1S/C20H20BrN3O2S/c21-15-6-7-18-17(14-15)19(25)24(16-4-2-1-3-5-16)20(22-18)27-13-10-23-8-11-26-12-9-23/h1-7,14H,8-13H2/p+1