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

Systemtic Name: N-(1-adamantylmethyl)-2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(1-adamantylmethyl)-2-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(1-adamantylmethyl)-2-[(3-ethyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-(1-adamantylmethyl)-2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(1-adamantylmethyl)-2-[(3-ethyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H29N3O2S/c1-2-26-21(28)18-5-3-4-6-19(18)25-22(26)29-13-20(27)24-14-23-10-15-7-16(11-23)9-17(8-15)12-23/h3-6,15-17H,2,7-14H2,1H3,(H,24,27)