ethyl 2-[2-(6-methoxy-2-phenyl-quinazolin-4-yl)sulfanylethanoylamino]ethanoate

Systemtic Name: ethyl 2-[2-(6-methoxy-2-phenyl-quinazolin-4-yl)sulfanylethanoylamino]ethanoate Openeye Name: ethyl 2-[[2-(6-methoxy-2-phenyl-quinazolin-4-yl)sulfanylacetyl]amino]acetate CAS Name: 2-[[2-[(6-methoxy-2-phenyl-4-quinazolinyl)thio]-1-oxoethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[2-(6-methoxy-2-phenylquinazolin-4-yl)sulfanylacetyl]amino]acetate Traditional Name: 2-[[2-[(6-methoxy-2-phenyl-quinazolin-4-yl)thio]acetyl]amino]acetic acid ethyl ester Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)CSC1=NC(=NC2=C1C=C(C=C2)OC)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CNC(=O)CSC1=NC(=NC2=C1C=C(C=C2)OC)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O4S/c1-3-28-19(26)12-22-18(25)13-29-21-16-11-15(27-2)9-10-17(16)23-20(24-21)14-7-5-4-6-8-14/h4-11H,3,12-13H2,1-2H3,(H,22,25)