N-(1-adamantylmethyl)-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(1-adamantylmethyl)-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(1-adamantylmethyl)-2-(3-methyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(1-adamantylmethyl)-2-[(3-methyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-(1-adamantylmethyl)-2-(3-methyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(1-adamantylmethyl)-2-[(4-keto-3-methyl-quinazolin-2-yl)thio]acetamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H27N3O2S/c1-25-20(27)17-4-2-3-5-18(17)24-21(25)28-12-19(26)23-13-22-9-14-6-15(10-22)8-16(7-14)11-22/h2-5,14-16H,6-13H2,1H3,(H,23,26)