N-(1-adamantylmethyl)-2-(2-methylquinazolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(1-adamantylmethyl)-2-(2-methylquinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N-(1-adamantylmethyl)-2-(2-methylquinazolin-4-yl)sulfanyl-acetamide CAS Name: N-(1-adamantylmethyl)-2-[(2-methyl-4-quinazolinyl)thio]acetamide IUPAC Name: N-(1-adamantylmethyl)-2-(2-methylquinazolin-4-yl)sulfanylacetamide Traditional Name: N-(1-adamantylmethyl)-2-[(2-methylquinazolin-4-yl)thio]acetamide Formula: C22H27N3OS MolecularWeight: 381.53428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H27N3OS/c1-14-24-19-5-3-2-4-18(19)21(25-14)27-12-20(26)23-13-22-9-15-6-16(10-22)8-17(7-15)11-22/h2-5,15-17H,6-13H2,1H3,(H,23,26)