ethyl N-[2-(3-butan-2-yl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoyl]carbamate

Systemtic Name: ethyl N-[2-(3-butan-2-yl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoyl]carbamate Openeye Name: ethyl N-[2-(4-oxo-3-sec-butyl-quinazolin-2-yl)sulfanylacetyl]carbamate CAS Name: N-[2-[(3-butan-2-yl-4-oxo-2-quinazolinyl)thio]-1-oxoethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-(3-butan-2-yl-4-oxoquinazolin-2-yl)sulfanylacetyl]carbamate Traditional Name: N-[2-[(4-keto-3-sec-butyl-quinazolin-2-yl)thio]acetyl]carbamic acid ethyl ester Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(=O)OCC

Isomeric SMILES

CCC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(=O)OCC

InChI

InChI=1S/C17H21N3O4S/c1-4-11(3)20-15(22)12-8-6-7-9-13(12)18-16(20)25-10-14(21)19-17(23)24-5-2/h6-9,11H,4-5,10H2,1-3H3,(H,19,21,23)