ethyl 2-[3-[(4S)-2,2-dimethyloxan-4-yl]-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[3-[(4S)-2,2-dimethyloxan-4-yl]-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[3-[(4S)-2,2-dimethyltetrahydropyran-4-yl]-4-oxo-quinazolin-2-yl]sulfanylacetate CAS Name: 2-[[3-[(4S)-2,2-dimethyl-4-oxanyl]-4-oxo-2-quinazolinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[(4S)-2,2-dimethyloxan-4-yl]-4-oxoquinazolin-2-yl]sulfanylacetate Traditional Name: 2-[[3-[(4S)-2,2-dimethyltetrahydropyran-4-yl]-4-keto-quinazolin-2-yl]thio]acetic acid ethyl ester Formula: C19H24N2O4S MolecularWeight: 376.46986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3CCOC(C3)(C)C

Isomeric SMILES

CCOC(=O)CSC1=NC2=CC=CC=C2C(=O)N1[C@H]3CCOC(C3)(C)C

InChI

InChI=1S/C19H24N2O4S/c1-4-24-16(22)12-26-18-20-15-8-6-5-7-14(15)17(23)21(18)13-9-10-25-19(2,3)11-13/h5-8,13H,4,9-12H2,1-3H3/t13-/m0/s1