N-[(1R)-1-(1-adamantyl)ethyl]-2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(C)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N[C@H](C)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H31N3O2S/c1-3-27-22(29)19-6-4-5-7-20(19)26-23(27)30-14-21(28)25-15(2)24-11-16-8-17(12-24)10-18(9-16)13-24/h4-7,15-18H,3,8-14H2,1-2H3,(H,25,28)/t15-,16?,17?,18?,24?/m1/s1