N-(1-adamantylcarbamoyl)-2-[4-oxidanylidene-3-[[(2R)-oxolan-2-yl]methyl]quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1-adamantylcarbamoyl)-2-[4-oxidanylidene-3-[[(2R)-oxolan-2-yl]methyl]quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(1-adamantylcarbamoyl)-2-[4-oxo-3-[[(2R)-tetrahydrofuran-2-yl]methyl]quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[(1-adamantylamino)-oxomethyl]-2-[[4-oxo-3-[[(2R)-2-oxolanyl]methyl]-2-quinazolinyl]thio]acetamide IUPAC Name: N-(1-adamantylcarbamoyl)-2-[4-oxo-3-[[(2R)-oxolan-2-yl]methyl]quinazolin-2-yl]sulfanylacetamide Traditional Name: N-(1-adamantylcarbamoyl)-2-[[4-keto-3-[[(2R)-tetrahydrofuran-2-yl]methyl]quinazolin-2-yl]thio]acetamide Formula: C26H32N4O4S MolecularWeight: 496.62168

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC(=O)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1C[C@@H](OC1)CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C26H32N4O4S/c31-22(28-24(33)29-26-11-16-8-17(12-26)10-18(9-16)13-26)15-35-25-27-21-6-2-1-5-20(21)23(32)30(25)14-19-4-3-7-34-19/h1-2,5-6,16-19H,3-4,7-15H2,(H2,28,29,31,33)/t16?,17?,18?,19-,26?/m1/s1