2-[2-(1-adamantyl)quinazolin-4-yl]sulfanyl-N-propan-2-yl-ethanamide

Systemtic Name: 2-[2-(1-adamantyl)quinazolin-4-yl]sulfanyl-N-propan-2-yl-ethanamide Openeye Name: 2-[2-(1-adamantyl)quinazolin-4-yl]sulfanyl-N-isopropyl-acetamide CAS Name: 2-[[2-(1-adamantyl)-4-quinazolinyl]thio]-N-propan-2-ylacetamide IUPAC Name: 2-[2-(1-adamantyl)quinazolin-4-yl]sulfanyl-N-propan-2-ylacetamide Traditional Name: 2-[[2-(1-adamantyl)quinazolin-4-yl]thio]-N-isopropyl-acetamide Formula: C23H29N3OS MolecularWeight: 395.56086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CSC1=NC(=NC2=CC=CC=C21)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C)NC(=O)CSC1=NC(=NC2=CC=CC=C21)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H29N3OS/c1-14(2)24-20(27)13-28-21-18-5-3-4-6-19(18)25-22(26-21)23-10-15-7-16(11-23)9-17(8-15)12-23/h3-6,14-17H,7-13H2,1-2H3,(H,24,27)