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

Systemtic Name: ethyl 4-(4-methoxyphenyl)-2-[4-(4-oxidanylidenequinazolin-3-yl)butanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-methoxyphenyl)-2-[4-(4-oxoquinazolin-3-yl)butanoylamino]thiophene-3-carboxylate CAS Name: 4-(4-methoxyphenyl)-2-[[1-oxo-4-(4-oxo-3-quinazolinyl)butyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methoxyphenyl)-2-[4-(4-oxoquinazolin-3-yl)butanoylamino]thiophene-3-carboxylate Traditional Name: 2-[4-(4-ketoquinazolin-3-yl)butanoylamino]-4-(4-methoxyphenyl)thiophene-3-carboxylic acid ethyl ester Formula: C26H25N3O5S MolecularWeight: 491.5588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)OC)NC(=O)CCCN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)OC)NC(=O)CCCN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C26H25N3O5S/c1-3-34-26(32)23-20(17-10-12-18(33-2)13-11-17)15-35-24(23)28-22(30)9-6-14-29-16-27-21-8-5-4-7-19(21)25(29)31/h4-5,7-8,10-13,15-16H,3,6,9,14H2,1-2H3,(H,28,30)