ethyl 4-[2-(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanylethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanylethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(4-oxo-3-propyl-quinazolin-2-yl)sulfanylacetyl]piperazine-1-carboxylate CAS Name: 4-[1-oxo-2-[(4-oxo-3-propyl-2-quinazolinyl)thio]ethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(4-oxo-3-propylquinazolin-2-yl)sulfanylacetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(4-keto-3-propyl-quinazolin-2-yl)thio]acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C20H26N4O4S MolecularWeight: 418.50984

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C20H26N4O4S/c1-3-9-24-18(26)15-7-5-6-8-16(15)21-19(24)29-14-17(25)22-10-12-23(13-11-22)20(27)28-4-2/h5-8H,3-4,9-14H2,1-2H3