methyl 2-[6-ethyl-2-(3-methylphenyl)quinazolin-4-yl]sulfanylethanoate

Systemtic Name: methyl 2-[6-ethyl-2-(3-methylphenyl)quinazolin-4-yl]sulfanylethanoate Openeye Name: methyl 2-[6-ethyl-2-(m-tolyl)quinazolin-4-yl]sulfanylacetate CAS Name: 2-[[6-ethyl-2-(3-methylphenyl)-4-quinazolinyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[6-ethyl-2-(3-methylphenyl)quinazolin-4-yl]sulfanylacetate Traditional Name: 2-[[6-ethyl-2-(m-tolyl)quinazolin-4-yl]thio]acetic acid methyl ester Formula: C20H20N2O2S MolecularWeight: 352.45

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N2O2S/c1-4-14-8-9-17-16(11-14)20(25-12-18(23)24-3)22-19(21-17)15-7-5-6-13(2)10-15/h5-11H,4,12H2,1-3H3