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

Systemtic Name: N-(1-adamantylmethyl)-2-(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(1-adamantylmethyl)-2-(4-oxo-3-propyl-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(1-adamantylmethyl)-2-[(4-oxo-3-propyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-(1-adamantylmethyl)-2-(4-oxo-3-propylquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(1-adamantylmethyl)-2-[(4-keto-3-propyl-quinazolin-2-yl)thio]acetamide Formula: C24H31N3O2S MolecularWeight: 425.58684

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H31N3O2S/c1-2-7-27-22(29)19-5-3-4-6-20(19)26-23(27)30-14-21(28)25-15-24-11-16-8-17(12-24)10-18(9-16)13-24/h3-6,16-18H,2,7-15H2,1H3,(H,25,28)