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

Systemtic Name: methyl 2-[2-[2-(aminocarbonylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[4-oxo-2-(2-oxo-2-ureido-ethyl)sulfanyl-quinazolin-3-yl]acetate CAS Name: 2-[2-[[2-(carbamoylamino)-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[2-(carbamoylamino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]acetate Traditional Name: 2-[4-keto-2-[(2-keto-2-ureido-ethyl)thio]quinazolin-3-yl]acetic acid methyl ester Formula: C14H14N4O5S MolecularWeight: 350.34976

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(=O)N

Isomeric SMILES

COC(=O)CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(=O)N

InChI

InChI=1S/C14H14N4O5S/c1-23-11(20)6-18-12(21)8-4-2-3-5-9(8)16-14(18)24-7-10(19)17-13(15)22/h2-5H,6-7H2,1H3,(H3,15,17,19,22)