3-(furan-2-ylmethyl)-2-(2-morpholin-4-ium-4-ylethylsulfanyl)quinazolin-4-one

Systemtic Name: 3-(furan-2-ylmethyl)-2-(2-morpholin-4-ium-4-ylethylsulfanyl)quinazolin-4-one Openeye Name: 3-(2-furylmethyl)-2-(2-morpholin-4-ium-4-ylethylsulfanyl)quinazolin-4-one CAS Name: 3-(2-furanylmethyl)-2-[2-(4-morpholin-4-iumyl)ethylthio]-4-quinazolinone IUPAC Name: 3-(furan-2-ylmethyl)-2-(2-morpholin-4-ium-4-ylethylsulfanyl)quinazolin-4-one Traditional Name: 3-(2-furfuryl)-2-(2-morpholin-4-ium-4-ylethylthio)quinazolin-4-one Formula: C19H22N3O3S+ MolecularWeight: 372.46128

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CO4

Isomeric SMILES

C1COCC[NH+]1CCSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CO4

InChI

InChI=1S/C19H21N3O3S/c23-18-16-5-1-2-6-17(16)20-19(22(18)14-15-4-3-10-25-15)26-13-9-21-7-11-24-12-8-21/h1-6,10H,7-9,11-14H2/p+1