methyl 3-[2-[2-(aminocarbonylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]propanoate

Systemtic Name: methyl 3-[2-[2-(aminocarbonylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]propanoate Openeye Name: methyl 3-[4-oxo-2-(2-oxo-2-ureido-ethyl)sulfanyl-quinazolin-3-yl]propanoate CAS Name: 3-[2-[[2-(carbamoylamino)-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-[2-(carbamoylamino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]propanoate Traditional Name: 3-[4-keto-2-[(2-keto-2-ureido-ethyl)thio]quinazolin-3-yl]propionic acid methyl ester Formula: C15H16N4O5S MolecularWeight: 364.37634

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(=O)N

Isomeric SMILES

COC(=O)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(=O)N

InChI

InChI=1S/C15H16N4O5S/c1-24-12(21)6-7-19-13(22)9-4-2-3-5-10(9)17-15(19)25-8-11(20)18-14(16)23/h2-5H,6-8H2,1H3,(H3,16,18,20,23)