tert-butyl 2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoate

Systemtic Name: tert-butyl 2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoate Openeye Name: tert-butyl 2-(3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanylacetate CAS Name: 2-[(3-cyclopentyl-4-oxo-2-quinazolinyl)thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanylacetate Traditional Name: 2-[(3-cyclopentyl-4-keto-quinazolin-2-yl)thio]acetic acid tert-butyl ester Formula: C19H24N2O3S MolecularWeight: 360.47046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3CCCC3

Isomeric SMILES

CC(C)(C)OC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3CCCC3

InChI

InChI=1S/C19H24N2O3S/c1-19(2,3)24-16(22)12-25-18-20-15-11-7-6-10-14(15)17(23)21(18)13-8-4-5-9-13/h6-7,10-11,13H,4-5,8-9,12H2,1-3H3