ethyl 2-[2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoylamino]benzoate

Systemtic Name: ethyl 2-[2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoylamino]benzoate Openeye Name: ethyl 2-[[2-(3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]amino]benzoate CAS Name: 2-[[2-[(3-cyclopentyl-4-oxo-2-quinazolinyl)thio]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[2-(3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanylacetyl]amino]benzoate Traditional Name: 2-[[2-[(3-cyclopentyl-4-keto-quinazolin-2-yl)thio]acetyl]amino]benzoic acid ethyl ester Formula: C24H25N3O4S MolecularWeight: 451.538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCC4

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCC4

InChI

InChI=1S/C24H25N3O4S/c1-2-31-23(30)18-12-6-8-14-20(18)25-21(28)15-32-24-26-19-13-7-5-11-17(19)22(29)27(24)16-9-3-4-10-16/h5-8,11-14,16H,2-4,9-10,15H2,1H3,(H,25,28)