ethyl 2-(2-cyclohexylquinazolin-4-yl)sulfanylethanoate

Systemtic Name: ethyl 2-(2-cyclohexylquinazolin-4-yl)sulfanylethanoate Openeye Name: ethyl 2-(2-cyclohexylquinazolin-4-yl)sulfanylacetate CAS Name: 2-[(2-cyclohexyl-4-quinazolinyl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(2-cyclohexylquinazolin-4-yl)sulfanylacetate Traditional Name: 2-[(2-cyclohexylquinazolin-4-yl)thio]acetic acid ethyl ester Formula: C18H22N2O2S MolecularWeight: 330.44448

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC(=NC2=CC=CC=C21)C3CCCCC3

Isomeric SMILES

CCOC(=O)CSC1=NC(=NC2=CC=CC=C21)C3CCCCC3

InChI

InChI=1S/C18H22N2O2S/c1-2-22-16(21)12-23-18-14-10-6-7-11-15(14)19-17(20-18)13-8-4-3-5-9-13/h6-7,10-11,13H,2-5,8-9,12H2,1H3