1-[4-(1-adamantylcarbonyl)piperazin-1-yl]-2-(2-phenyl-1,3-thiazol-4-yl)ethanone

Systemtic Name: 1-[4-(1-adamantylcarbonyl)piperazin-1-yl]-2-(2-phenyl-1,3-thiazol-4-yl)ethanone Openeye Name: 1-[4-(adamantane-1-carbonyl)piperazin-1-yl]-2-(2-phenylthiazol-4-yl)ethanone CAS Name: 1-[4-[1-adamantyl(oxo)methyl]-1-piperazinyl]-2-(2-phenyl-4-thiazolyl)ethanone IUPAC Name: 1-[4-(adamantane-1-carbonyl)piperazin-1-yl]-2-(2-phenyl-1,3-thiazol-4-yl)ethanone Traditional Name: 1-[4-(adamantane-1-carbonyl)piperazino]-2-(2-phenylthiazol-4-yl)ethanone Formula: C26H31N3O2S MolecularWeight: 449.60824

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC2=CSC(=N2)C3=CC=CC=C3)C(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CN(CCN1C(=O)CC2=CSC(=N2)C3=CC=CC=C3)C(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C26H31N3O2S/c30-23(13-22-17-32-24(27-22)21-4-2-1-3-5-21)28-6-8-29(9-7-28)25(31)26-14-18-10-19(15-26)12-20(11-18)16-26/h1-5,17-20H,6-16H2