ethyl 2-[2-[2-(phenylmethyl)quinazolin-4-yl]sulfanylethanoylamino]ethanoate

Systemtic Name: ethyl 2-[2-[2-(phenylmethyl)quinazolin-4-yl]sulfanylethanoylamino]ethanoate Openeye Name: ethyl 2-[[2-(2-benzylquinazolin-4-yl)sulfanylacetyl]amino]acetate CAS Name: 2-[[1-oxo-2-[[2-(phenylmethyl)-4-quinazolinyl]thio]ethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-(2-benzylquinazolin-4-yl)sulfanylacetyl]amino]acetate Traditional Name: 2-[[2-[(2-benzylquinazolin-4-yl)thio]acetyl]amino]acetic acid ethyl ester Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)CSC1=NC(=NC2=CC=CC=C21)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CNC(=O)CSC1=NC(=NC2=CC=CC=C21)CC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O3S/c1-2-27-20(26)13-22-19(25)14-28-21-16-10-6-7-11-17(16)23-18(24-21)12-15-8-4-3-5-9-15/h3-11H,2,12-14H2,1H3,(H,22,25)