1-[6-ethyl-2-(3-methylphenyl)quinazolin-4-yl]sulfanylpropan-2-one

Systemtic Name: 1-[6-ethyl-2-(3-methylphenyl)quinazolin-4-yl]sulfanylpropan-2-one Openeye Name: 1-[6-ethyl-2-(m-tolyl)quinazolin-4-yl]sulfanylpropan-2-one CAS Name: 1-[[6-ethyl-2-(3-methylphenyl)-4-quinazolinyl]thio]-2-propanone IUPAC Name: 1-[6-ethyl-2-(3-methylphenyl)quinazolin-4-yl]sulfanylpropan-2-one Traditional Name: 1-[[6-ethyl-2-(m-tolyl)quinazolin-4-yl]thio]acetone Formula: C20H20N2OS MolecularWeight: 336.4506

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(N=C2SCC(=O)C)C3=CC(=CC=C3)C

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(N=C2SCC(=O)C)C3=CC(=CC=C3)C

InChI

InChI=1S/C20H20N2OS/c1-4-15-8-9-18-17(11-15)20(24-12-14(3)23)22-19(21-18)16-7-5-6-13(2)10-16/h5-11H,4,12H2,1-3H3