ethyl 2-[2-[3-(4-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[3-(4-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[2-[3-(4-fluorophenyl)-4-oxo-quinazolin-2-yl]sulfanylpropanoylamino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[[3-(4-fluorophenyl)-4-oxo-2-quinazolinyl]thio]-1-oxopropyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-[3-(4-fluorophenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoylamino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[2-[[3-(4-fluorophenyl)-4-keto-quinazolin-2-yl]thio]propanoylamino]-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C30H24FN3O4S2 MolecularWeight: 573.657663

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C(C)SC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)F

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C(C)SC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)F

InChI

InChI=1S/C30H24FN3O4S2/c1-3-38-29(37)23-17-25(19-9-5-4-6-10-19)40-27(23)33-26(35)18(2)39-30-32-24-12-8-7-11-22(24)28(36)34(30)21-15-13-20(31)14-16-21/h4-18H,3H2,1-2H3,(H,33,35)