ethyl 2,4-dimethyl-5-[2-(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanylpropanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[2-(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanylpropanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[2-(4-oxo-3-propyl-quinazolin-2-yl)sulfanylpropanoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[1-oxo-2-[(4-oxo-3-propyl-2-quinazolinyl)thio]propyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[2-(4-oxo-3-propylquinazolin-2-yl)sulfanylpropanoyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-[(4-keto-3-propyl-quinazolin-2-yl)thio]propanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)C3=C(C(=C(N3)C)C(=O)OCC)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)C3=C(C(=C(N3)C)C(=O)OCC)C

InChI

InChI=1S/C23H27N3O4S/c1-6-12-26-21(28)16-10-8-9-11-17(16)25-23(26)31-15(5)20(27)19-13(3)18(14(4)24-19)22(29)30-7-2/h8-11,15,24H,6-7,12H2,1-5H3