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

Systemtic Name: methyl 3-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-oxidanylidene-quinazolin-3-yl]propanoate Openeye Name: methyl 3-[2-(2-amino-2-oxo-ethyl)sulfanyl-4-oxo-quinazolin-3-yl]propanoate CAS Name: 3-[2-[(2-amino-2-oxoethyl)thio]-4-oxo-3-quinazolinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-(2-amino-2-oxoethyl)sulfanyl-4-oxoquinazolin-3-yl]propanoate Traditional Name: 3-[2-[(2-amino-2-keto-ethyl)thio]-4-keto-quinazolin-3-yl]propionic acid methyl ester Formula: C14H15N3O4S MolecularWeight: 321.3516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N3O4S/c1-21-12(19)6-7-17-13(20)9-4-2-3-5-10(9)16-14(17)22-8-11(15)18/h2-5H,6-8H2,1H3,(H2,15,18)