methyl 4-[2-(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanylethanoylamino]butanoate

Systemtic Name: methyl 4-[2-(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanylethanoylamino]butanoate Openeye Name: methyl 4-[[2-(4-oxo-3-propyl-quinazolin-2-yl)sulfanylacetyl]amino]butanoate CAS Name: 4-[[1-oxo-2-[(4-oxo-3-propyl-2-quinazolinyl)thio]ethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[2-(4-oxo-3-propylquinazolin-2-yl)sulfanylacetyl]amino]butanoate Traditional Name: 4-[[2-[(4-keto-3-propyl-quinazolin-2-yl)thio]acetyl]amino]butyric acid methyl ester Formula: C18H23N3O4S MolecularWeight: 377.45792

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCCCC(=O)OC

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCCCC(=O)OC

InChI

InChI=1S/C18H23N3O4S/c1-3-11-21-17(24)13-7-4-5-8-14(13)20-18(21)26-12-15(22)19-10-6-9-16(23)25-2/h4-5,7-8H,3,6,9-12H2,1-2H3,(H,19,22)