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

Systemtic Name: ethyl 5-ethanoyl-2-[2-(6-ethoxy-2-phenyl-quinazolin-4-yl)sulfanylethanoylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-2-[[2-(6-ethoxy-2-phenyl-quinazolin-4-yl)sulfanylacetyl]amino]-4-methyl-thiophene-3-carboxylate CAS Name: 5-acetyl-2-[[2-[(6-ethoxy-2-phenyl-4-quinazolinyl)thio]-1-oxoethyl]amino]-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-2-[[2-(6-ethoxy-2-phenylquinazolin-4-yl)sulfanylacetyl]amino]-4-methylthiophene-3-carboxylate Traditional Name: 5-acetyl-2-[[2-[(6-ethoxy-2-phenyl-quinazolin-4-yl)thio]acetyl]amino]-4-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C28H27N3O5S2 MolecularWeight: 549.66108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(N=C2SCC(=O)NC3=C(C(=C(S3)C(=O)C)C)C(=O)OCC)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(N=C2SCC(=O)NC3=C(C(=C(S3)C(=O)C)C)C(=O)OCC)C4=CC=CC=C4

InChI

InChI=1S/C28H27N3O5S2/c1-5-35-19-12-13-21-20(14-19)26(31-25(29-21)18-10-8-7-9-11-18)37-15-22(33)30-27-23(28(34)36-6-2)16(3)24(38-27)17(4)32/h7-14H,5-6,15H2,1-4H3,(H,30,33)