ethyl (2S)-2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-2-phenyl-ethanoate

Systemtic Name: ethyl (2S)-2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-2-phenyl-ethanoate Openeye Name: ethyl (2S)-2-(3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanyl-2-phenyl-acetate CAS Name: (2S)-2-[(3-cyclopentyl-4-oxo-2-quinazolinyl)thio]-2-phenylacetic acid ethyl ester IUPAC Name: ethyl (2S)-2-(3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanyl-2-phenylacetate Traditional Name: (2S)-2-[(3-cyclopentyl-4-keto-quinazolin-2-yl)thio]-2-phenyl-acetic acid ethyl ester Formula: C23H24N2O3S MolecularWeight: 408.51326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=CC=C1)SC2=NC3=CC=CC=C3C(=O)N2C4CCCC4

Isomeric SMILES

CCOC(=O)[C@H](C1=CC=CC=C1)SC2=NC3=CC=CC=C3C(=O)N2C4CCCC4

InChI

InChI=1S/C23H24N2O3S/c1-2-28-22(27)20(16-10-4-3-5-11-16)29-23-24-19-15-9-8-14-18(19)21(26)25(23)17-12-6-7-13-17/h3-5,8-11,14-15,17,20H,2,6-7,12-13H2,1H3/t20-/m0/s1