ethyl 5-phenyl-2-(2-quinazolin-4-ylsulfanylpropanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 5-phenyl-2-(2-quinazolin-4-ylsulfanylpropanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-phenyl-2-(2-quinazolin-4-ylsulfanylpropanoylamino)thiophene-3-carboxylate CAS Name: 2-[[1-oxo-2-(4-quinazolinylthio)propyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-phenyl-2-(2-quinazolin-4-ylsulfanylpropanoylamino)thiophene-3-carboxylate Traditional Name: 5-phenyl-2-[2-(quinazolin-4-ylthio)propanoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C24H21N3O3S2 MolecularWeight: 463.57184

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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=NC=NC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C(C)SC3=NC=NC4=CC=CC=C43

InChI

InChI=1S/C24H21N3O3S2/c1-3-30-24(29)18-13-20(16-9-5-4-6-10-16)32-23(18)27-21(28)15(2)31-22-17-11-7-8-12-19(17)25-14-26-22/h4-15H,3H2,1-2H3,(H,27,28)