methyl (2R)-2-[3-(2-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoate

Systemtic Name: methyl (2R)-2-[3-(2-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoate Openeye Name: methyl (2R)-2-[3-(2-ethoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanylpropanoate CAS Name: (2R)-2-[[3-(2-ethoxyphenyl)-4-oxo-2-quinazolinyl]thio]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[3-(2-ethoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate Traditional Name: (2R)-2-[(4-keto-3-o-phenetyl-quinazolin-2-yl)thio]propionic acid methyl ester Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)OC

Isomeric SMILES

CCOC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2S[C@H](C)C(=O)OC

InChI

InChI=1S/C20H20N2O4S/c1-4-26-17-12-8-7-11-16(17)22-18(23)14-9-5-6-10-15(14)21-20(22)27-13(2)19(24)25-3/h5-13H,4H2,1-3H3/t13-/m1/s1