2-[3-(5-methylnaphthalen-1-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[3-(5-methylnaphthalen-1-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoic acid Openeye Name: 2-[3-(5-methyl-1-naphthyl)-4-oxo-quinazolin-2-yl]sulfanylacetic acid CAS Name: 2-[[3-(5-methyl-1-naphthalenyl)-4-oxo-2-quinazolinyl]thio]acetic acid IUPAC Name: 2-[3-(5-methylnaphthalen-1-yl)-4-oxoquinazolin-2-yl]sulfanylacetic acid Traditional Name: 2-[[4-keto-3-(5-methyl-1-naphthyl)quinazolin-2-yl]thio]acetic acid Formula: C21H16N2O3S MolecularWeight: 376.42834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1C=CC=C2N3C(=O)C4=CC=CC=C4N=C3SCC(=O)O

Isomeric SMILES

CC1=CC=CC2=C1C=CC=C2N3C(=O)C4=CC=CC=C4N=C3SCC(=O)O

InChI

InChI=1S/C21H16N2O3S/c1-13-6-4-9-15-14(13)8-5-11-18(15)23-20(26)16-7-2-3-10-17(16)22-21(23)27-12-19(24)25/h2-11H,12H2,1H3,(H,24,25)