ethyl 2-[2-(6-fluoranyl-2-phenyl-quinazolin-4-yl)sulfanylethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(6-fluoranyl-2-phenyl-quinazolin-4-yl)sulfanylethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(6-fluoro-2-phenyl-quinazolin-4-yl)sulfanylacetyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[2-[(6-fluoro-2-phenyl-4-quinazolinyl)thio]-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(6-fluoro-2-phenylquinazolin-4-yl)sulfanylacetyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[2-[(6-fluoro-2-phenyl-quinazolin-4-yl)thio]acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H22FN3O3S2 MolecularWeight: 495.588883

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CSC2=NC(=NC3=C2C=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CSC2=NC(=NC3=C2C=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C25H22FN3O3S2/c1-4-32-25(31)21-14(2)15(3)34-24(21)28-20(30)13-33-23-18-12-17(26)10-11-19(18)27-22(29-23)16-8-6-5-7-9-16/h5-12H,4,13H2,1-3H3,(H,28,30)