4-tert-butyl-N-[2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoyl]benzamide

Systemtic Name: 4-tert-butyl-N-[2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoyl]benzamide Openeye Name: 4-tert-butyl-N-[2-(3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]benzamide CAS Name: 4-tert-butyl-N-[2-[(3-cyclopentyl-4-oxo-2-quinazolinyl)thio]-1-oxoethyl]benzamide IUPAC Name: 4-tert-butyl-N-[2-(3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanylacetyl]benzamide Traditional Name: 4-tert-butyl-N-[2-[(3-cyclopentyl-4-keto-quinazolin-2-yl)thio]acetyl]benzamide Formula: C26H29N3O3S MolecularWeight: 463.59176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCC4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCC4

InChI

InChI=1S/C26H29N3O3S/c1-26(2,3)18-14-12-17(13-15-18)23(31)28-22(30)16-33-25-27-21-11-7-6-10-20(21)24(32)29(25)19-8-4-5-9-19/h6-7,10-15,19H,4-5,8-9,16H2,1-3H3,(H,28,30,31)