propan-2-yl 2-[3-(2-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate

Systemtic Name: propan-2-yl 2-[3-(2-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate Openeye Name: isopropyl 2-[3-(2-ethylphenyl)-4-oxo-quinazolin-2-yl]sulfanylacetate CAS Name: 2-[[3-(2-ethylphenyl)-4-oxo-2-quinazolinyl]thio]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[3-(2-ethylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetate Traditional Name: 2-[[3-(2-ethylphenyl)-4-keto-quinazolin-2-yl]thio]acetic acid isopropyl ester Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)OC(C)C

Isomeric SMILES

CCC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)OC(C)C

InChI

InChI=1S/C21H22N2O3S/c1-4-15-9-5-8-12-18(15)23-20(25)16-10-6-7-11-17(16)22-21(23)27-13-19(24)26-14(2)3/h5-12,14H,4,13H2,1-3H3