methyl 2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoate

Systemtic Name: methyl 2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoate Openeye Name: methyl 2-(3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanylacetate CAS Name: 2-[(3-cyclopentyl-4-oxo-2-quinazolinyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanylacetate Traditional Name: 2-[(3-cyclopentyl-4-keto-quinazolin-2-yl)thio]acetic acid methyl ester Formula: C16H18N2O3S MolecularWeight: 318.39072

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3CCCC3

Isomeric SMILES

COC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3CCCC3

InChI

InChI=1S/C16H18N2O3S/c1-21-14(19)10-22-16-17-13-9-5-4-8-12(13)15(20)18(16)11-6-2-3-7-11/h4-5,8-9,11H,2-3,6-7,10H2,1H3