N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-(4-oxidanylidene-1H-quinazolin-2-yl)butanamide

Systemtic Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-(4-oxidanylidene-1H-quinazolin-2-yl)butanamide Openeye Name: N-[4-(1-adamantyl)thiazol-2-yl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide CAS Name: N-[4-(1-adamantyl)-2-thiazolyl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide IUPAC Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide Traditional Name: N-[4-(1-adamantyl)thiazol-2-yl]-4-(4-keto-1H-quinazolin-2-yl)butyramide Formula: C25H28N4O2S MolecularWeight: 448.58042

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CSC(=N4)NC(=O)CCCC5=NC(=O)C6=CC=CC=C6N5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CSC(=N4)NC(=O)CCCC5=NC(=O)C6=CC=CC=C6N5

InChI

InChI=1S/C25H28N4O2S/c30-22(7-3-6-21-26-19-5-2-1-4-18(19)23(31)28-21)29-24-27-20(14-32-24)25-11-15-8-16(12-25)10-17(9-15)13-25/h1-2,4-5,14-17H,3,6-13H2,(H,26,28,31)(H,27,29,30)