2-[(2,4,6-trimethylphenyl)sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(2,4,6-trimethylphenyl)sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[(2,4,6-trimethylphenyl)sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2-[[(2,4,6-trimethylphenyl)thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[(2,4,6-trimethylphenyl)sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[(mesitylthio)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)SCC2=NC(=O)C3=CC=CC=C3N2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)SCC2=NC(=O)C3=CC=CC=C3N2)C

InChI

InChI=1S/C18H18N2OS/c1-11-8-12(2)17(13(3)9-11)22-10-16-19-15-7-5-4-6-14(15)18(21)20-16/h4-9H,10H2,1-3H3,(H,19,20,21)