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

Systemtic Name: ethyl 4-[2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoylamino]butanoate Openeye Name: ethyl 4-[[2-(3-methyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]amino]butanoate CAS Name: 4-[[2-[(3-methyl-4-oxo-2-quinazolinyl)thio]-1-oxoethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(3-methyl-4-oxoquinazolin-2-yl)sulfanylacetyl]amino]butanoate Traditional Name: 4-[[2-[(4-keto-3-methyl-quinazolin-2-yl)thio]acetyl]amino]butyric acid ethyl ester Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C

Isomeric SMILES

CCOC(=O)CCCNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C

InChI

InChI=1S/C17H21N3O4S/c1-3-24-15(22)9-6-10-18-14(21)11-25-17-19-13-8-5-4-7-12(13)16(23)20(17)2/h4-5,7-8H,3,6,9-11H2,1-2H3,(H,18,21)