2-(2-morpholin-4-ium-4-ylethylsulfanyl)-3-phenethyl-quinazolin-4-one

Systemtic Name: 2-(2-morpholin-4-ium-4-ylethylsulfanyl)-3-phenethyl-quinazolin-4-one Openeye Name: 2-(2-morpholin-4-ium-4-ylethylsulfanyl)-3-phenethyl-quinazolin-4-one CAS Name: 2-[2-(4-morpholin-4-iumyl)ethylthio]-3-phenethyl-4-quinazolinone IUPAC Name: 2-(2-morpholin-4-ium-4-ylethylsulfanyl)-3-phenethylquinazolin-4-one Traditional Name: 2-(2-morpholin-4-ium-4-ylethylthio)-3-phenethyl-quinazolin-4-one Formula: C22H26N3O2S+ MolecularWeight: 396.52574

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCSC2=NC3=CC=CC=C3C(=O)N2CCC4=CC=CC=C4

Isomeric SMILES

C1COCC[NH+]1CCSC2=NC3=CC=CC=C3C(=O)N2CCC4=CC=CC=C4

InChI

InChI=1S/C22H25N3O2S/c26-21-19-8-4-5-9-20(19)23-22(28-17-14-24-12-15-27-16-13-24)25(21)11-10-18-6-2-1-3-7-18/h1-9H,10-17H2/p+1