ethyl 4-methyl-2-[2-[4-oxidanylidene-3-(4-propan-2-ylphenyl)quinazolin-2-yl]sulfanylethanoylamino]-5-(phenylcarbamoyl)thiophene-3-carboxylate

Systemtic Name: ethyl 4-methyl-2-[2-[4-oxidanylidene-3-(4-propan-2-ylphenyl)quinazolin-2-yl]sulfanylethanoylamino]-5-(phenylcarbamoyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[3-(4-isopropylphenyl)-4-oxo-quinazolin-2-yl]sulfanylacetyl]amino]-4-methyl-5-(phenylcarbamoyl)thiophene-3-carboxylate CAS Name: 5-[anilino(oxo)methyl]-4-methyl-2-[[1-oxo-2-[[4-oxo-3-(4-propan-2-ylphenyl)-2-quinazolinyl]thio]ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[[2-[4-oxo-3-(4-propan-2-ylphenyl)quinazolin-2-yl]sulfanylacetyl]amino]-5-(phenylcarbamoyl)thiophene-3-carboxylate Traditional Name: 2-[[2-[(4-keto-3-p-cumenyl-quinazolin-2-yl)thio]acetyl]amino]-4-methyl-5-(phenylcarbamoyl)thiophene-3-carboxylic acid ethyl ester Formula: C34H32N4O5S2 MolecularWeight: 640.77168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2)NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2)NC(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C(C)C

InChI

InChI=1S/C34H32N4O5S2/c1-5-43-33(42)28-21(4)29(30(40)35-23-11-7-6-8-12-23)45-31(28)37-27(39)19-44-34-36-26-14-10-9-13-25(26)32(41)38(34)24-17-15-22(16-18-24)20(2)3/h6-18,20H,5,19H2,1-4H3,(H,35,40)(H,37,39)