ethyl 5-(4-methoxyphenyl)-3-[3-(4-oxidanylidenequinazolin-3-yl)propanoylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 5-(4-methoxyphenyl)-3-[3-(4-oxidanylidenequinazolin-3-yl)propanoylamino]thiophene-2-carboxylate Openeye Name: ethyl 5-(4-methoxyphenyl)-3-[3-(4-oxoquinazolin-3-yl)propanoylamino]thiophene-2-carboxylate CAS Name: 5-(4-methoxyphenyl)-3-[[1-oxo-3-(4-oxo-3-quinazolinyl)propyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-methoxyphenyl)-3-[3-(4-oxoquinazolin-3-yl)propanoylamino]thiophene-2-carboxylate Traditional Name: 3-[3-(4-ketoquinazolin-3-yl)propanoylamino]-5-(4-methoxyphenyl)thiophene-2-carboxylic acid ethyl ester Formula: C25H23N3O5S MolecularWeight: 477.53222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=C(C=C2)OC)NC(=O)CCN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=C(C=C2)OC)NC(=O)CCN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C25H23N3O5S/c1-3-33-25(31)23-20(14-21(34-23)16-8-10-17(32-2)11-9-16)27-22(29)12-13-28-15-26-19-7-5-4-6-18(19)24(28)30/h4-11,14-15H,3,12-13H2,1-2H3,(H,27,29)