ethyl (2S)-2-[(4-oxidanylidene-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)sulfanyl]-2-phenyl-ethanoate

Systemtic Name: ethyl (2S)-2-[(4-oxidanylidene-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)sulfanyl]-2-phenyl-ethanoate Openeye Name: ethyl (2S)-2-[(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)sulfanyl]-2-phenyl-acetate CAS Name: (2S)-2-[(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)thio]-2-phenylacetic acid ethyl ester IUPAC Name: ethyl (2S)-2-[(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)sulfanyl]-2-phenylacetate Traditional Name: (2S)-2-[(4-keto-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)thio]-2-phenyl-acetic acid ethyl ester Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=CC=C1)SC2=NC(=O)C3=C(N2)CCCC3

Isomeric SMILES

CCOC(=O)[C@H](C1=CC=CC=C1)SC2=NC(=O)C3=C(N2)CCCC3

InChI

InChI=1S/C18H20N2O3S/c1-2-23-17(22)15(12-8-4-3-5-9-12)24-18-19-14-11-7-6-10-13(14)16(21)20-18/h3-5,8-9,15H,2,6-7,10-11H2,1H3,(H,19,20,21)/t15-/m0/s1