2-[2-(2,6-dimethylphenoxy)ethylsulfanyl]-1H-quinazolin-4-one

Systemtic Name: 2-[2-(2,6-dimethylphenoxy)ethylsulfanyl]-1H-quinazolin-4-one Openeye Name: 2-[2-(2,6-dimethylphenoxy)ethylsulfanyl]-1H-quinazolin-4-one CAS Name: 2-[2-(2,6-dimethylphenoxy)ethylthio]-1H-quinazolin-4-one IUPAC Name: 2-[2-(2,6-dimethylphenoxy)ethylsulfanyl]-1H-quinazolin-4-one Traditional Name: 2-[2-(2,6-dimethylphenoxy)ethylthio]-1H-quinazolin-4-one Formula: C18H18N2O2S MolecularWeight: 326.41272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCSC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCSC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C18H18N2O2S/c1-12-6-5-7-13(2)16(12)22-10-11-23-18-19-15-9-4-3-8-14(15)17(21)20-18/h3-9H,10-11H2,1-2H3,(H,19,20,21)