2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethyl benzoate

Systemtic Name: 2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethyl benzoate Openeye Name: 2-(3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanylethyl benzoate CAS Name: benzoic acid 2-[(3-cyclopentyl-4-oxo-2-quinazolinyl)thio]ethyl ester IUPAC Name: 2-(3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanylethyl benzoate Traditional Name: benzoic acid 2-[(3-cyclopentyl-4-keto-quinazolin-2-yl)thio]ethyl ester Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=O)C3=CC=CC=C3N=C2SCCOC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)N2C(=O)C3=CC=CC=C3N=C2SCCOC(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H22N2O3S/c25-20-18-12-6-7-13-19(18)23-22(24(20)17-10-4-5-11-17)28-15-14-27-21(26)16-8-2-1-3-9-16/h1-3,6-9,12-13,17H,4-5,10-11,14-15H2