methyl 2-(2-quinazolin-4-ylsulfanylethanoylamino)ethanoate

Systemtic Name: methyl 2-(2-quinazolin-4-ylsulfanylethanoylamino)ethanoate Openeye Name: methyl 2-[(2-quinazolin-4-ylsulfanylacetyl)amino]acetate CAS Name: 2-[[1-oxo-2-(4-quinazolinylthio)ethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[(2-quinazolin-4-ylsulfanylacetyl)amino]acetate Traditional Name: 2-[[2-(quinazolin-4-ylthio)acetyl]amino]acetic acid methyl ester Formula: C13H13N3O3S MolecularWeight: 291.32562

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)CSC1=NC=NC2=CC=CC=C21

Isomeric SMILES

COC(=O)CNC(=O)CSC1=NC=NC2=CC=CC=C21

InChI

InChI=1S/C13H13N3O3S/c1-19-12(18)6-14-11(17)7-20-13-9-4-2-3-5-10(9)15-8-16-13/h2-5,8H,6-7H2,1H3,(H,14,17)