ethyl 4-ethanoyl-5-methyl-2-(2-quinazolin-4-ylsulfanylethanoylamino)furan-3-carboxylate

Systemtic Name: ethyl 4-ethanoyl-5-methyl-2-(2-quinazolin-4-ylsulfanylethanoylamino)furan-3-carboxylate Openeye Name: ethyl 4-acetyl-5-methyl-2-[(2-quinazolin-4-ylsulfanylacetyl)amino]furan-3-carboxylate CAS Name: 4-acetyl-5-methyl-2-[[1-oxo-2-(4-quinazolinylthio)ethyl]amino]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 4-acetyl-5-methyl-2-[(2-quinazolin-4-ylsulfanylacetyl)amino]furan-3-carboxylate Traditional Name: 4-acetyl-5-methyl-2-[[2-(quinazolin-4-ylthio)acetyl]amino]furan-3-carboxylic acid ethyl ester Formula: C20H19N3O5S MolecularWeight: 413.44696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1C(=O)C)C)NC(=O)CSC2=NC=NC3=CC=CC=C32

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1C(=O)C)C)NC(=O)CSC2=NC=NC3=CC=CC=C32

InChI

InChI=1S/C20H19N3O5S/c1-4-27-20(26)17-16(11(2)24)12(3)28-18(17)23-15(25)9-29-19-13-7-5-6-8-14(13)21-10-22-19/h5-8,10H,4,9H2,1-3H3,(H,23,25)