ethyl 5-ethanoyl-2-[2-[6-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanylethanoylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethanoyl-2-[2-[6-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanylethanoylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-[[2-[6-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanylacetyl]amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-2-[[2-[[6-ethyl-2-(4-fluorophenyl)-4-quinazolinyl]thio]-1-oxoethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-2-[[2-[6-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]sulfanylacetyl]amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-acetyl-2-[[2-[[6-ethyl-2-(4-fluorophenyl)quinazolin-4-yl]thio]acetyl]amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C28H26FN3O4S2 MolecularWeight: 551.652143

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(N=C2SCC(=O)NC3=C(C(=C(S3)C(=O)C)C)C(=O)OCC)C4=CC=C(C=C4)F

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(N=C2SCC(=O)NC3=C(C(=C(S3)C(=O)C)C)C(=O)OCC)C4=CC=C(C=C4)F

InChI

InChI=1S/C28H26FN3O4S2/c1-5-17-7-12-21-20(13-17)26(32-25(30-21)18-8-10-19(29)11-9-18)37-14-22(34)31-27-23(28(35)36-6-2)15(3)24(38-27)16(4)33/h7-13H,5-6,14H2,1-4H3,(H,31,34)