2-[2-(3,4-dimethylphenoxy)ethylsulfanyl]-1H-quinazolin-4-one

Systemtic Name: 2-[2-(3,4-dimethylphenoxy)ethylsulfanyl]-1H-quinazolin-4-one Openeye Name: 2-[2-(3,4-dimethylphenoxy)ethylsulfanyl]-1H-quinazolin-4-one CAS Name: 2-[2-(3,4-dimethylphenoxy)ethylthio]-1H-quinazolin-4-one IUPAC Name: 2-[2-(3,4-dimethylphenoxy)ethylsulfanyl]-1H-quinazolin-4-one Traditional Name: 2-[2-(3,4-dimethylphenoxy)ethylthio]-1H-quinazolin-4-one Formula: C18H18N2O2S MolecularWeight: 326.41272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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