2-[(2,5-dimethylphenyl)methylsulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(2,5-dimethylphenyl)methylsulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[(2,5-dimethylphenyl)methylsulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2-[[(2,5-dimethylphenyl)methylthio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[(2,5-dimethylphenyl)methylsulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[[(2,5-dimethylbenzyl)thio]methyl]-1H-quinazolin-4-one Formula: C18H18N2OS MolecularWeight: 310.41332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSCC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSCC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C18H18N2OS/c1-12-7-8-13(2)14(9-12)10-22-11-17-19-16-6-4-3-5-15(16)18(21)20-17/h3-9H,10-11H2,1-2H3,(H,19,20,21)