methyl 2-[2-(2-cyclopropylquinazolin-4-yl)sulfanylethanoylamino]ethanoate

Systemtic Name: methyl 2-[2-(2-cyclopropylquinazolin-4-yl)sulfanylethanoylamino]ethanoate Openeye Name: methyl 2-[[2-(2-cyclopropylquinazolin-4-yl)sulfanylacetyl]amino]acetate CAS Name: 2-[[2-[(2-cyclopropyl-4-quinazolinyl)thio]-1-oxoethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-(2-cyclopropylquinazolin-4-yl)sulfanylacetyl]amino]acetate Traditional Name: 2-[[2-[(2-cyclopropylquinazolin-4-yl)thio]acetyl]amino]acetic acid methyl ester Formula: C16H17N3O3S MolecularWeight: 331.38948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)CSC1=NC(=NC2=CC=CC=C21)C3CC3

Isomeric SMILES

COC(=O)CNC(=O)CSC1=NC(=NC2=CC=CC=C21)C3CC3

InChI

InChI=1S/C16H17N3O3S/c1-22-14(21)8-17-13(20)9-23-16-11-4-2-3-5-12(11)18-15(19-16)10-6-7-10/h2-5,10H,6-9H2,1H3,(H,17,20)