2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanylquinazoline-4-carboxylic acid

Systemtic Name: 2-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanylquinazoline-4-carboxylic acid Openeye Name: 2-[2-oxo-2-(p-tolyl)ethyl]sulfanylquinazoline-4-carboxylic acid CAS Name: 2-[[2-(4-methylphenyl)-2-oxoethyl]thio]-4-quinazolinecarboxylic acid IUPAC Name: 2-[2-(4-methylphenyl)-2-oxoethyl]sulfanylquinazoline-4-carboxylic acid Traditional Name: 2-[[2-keto-2-(p-tolyl)ethyl]thio]quinazoline-4-carboxylic acid Formula: C18H14N2O3S MolecularWeight: 338.38036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=N2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=N2)C(=O)O

InChI

InChI=1S/C18H14N2O3S/c1-11-6-8-12(9-7-11)15(21)10-24-18-19-14-5-3-2-4-13(14)16(20-18)17(22)23/h2-9H,10H2,1H3,(H,22,23)