butyl 2-[4-oxidanylidene-3-[(1R)-1-phenylethyl]quinazolin-2-yl]sulfanylethanoate

Systemtic Name: butyl 2-[4-oxidanylidene-3-[(1R)-1-phenylethyl]quinazolin-2-yl]sulfanylethanoate Openeye Name: butyl 2-[4-oxo-3-[(1R)-1-phenylethyl]quinazolin-2-yl]sulfanylacetate CAS Name: 2-[[4-oxo-3-[(1R)-1-phenylethyl]-2-quinazolinyl]thio]acetic acid butyl ester IUPAC Name: butyl 2-[4-oxo-3-[(1R)-1-phenylethyl]quinazolin-2-yl]sulfanylacetate Traditional Name: 2-[[4-keto-3-[(1R)-1-phenylethyl]quinazolin-2-yl]thio]acetic acid butyl ester Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C(C)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O3S/c1-3-4-14-27-20(25)15-28-22-23-19-13-9-8-12-18(19)21(26)24(22)16(2)17-10-6-5-7-11-17/h5-13,16H,3-4,14-15H2,1-2H3/t16-/m1/s1