[4-(1-adamantylcarbonyl)piperazin-1-yl]-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanone

Systemtic Name: [4-(1-adamantylcarbonyl)piperazin-1-yl]-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanone Openeye Name: [4-(adamantane-1-carbonyl)piperazin-1-yl]-(4-methyl-2-phenyl-thiazol-5-yl)methanone CAS Name: [4-[1-adamantyl(oxo)methyl]-1-piperazinyl]-(4-methyl-2-phenyl-5-thiazolyl)methanone IUPAC Name: [4-(adamantane-1-carbonyl)piperazin-1-yl]-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanone Traditional Name: [4-(adamantane-1-carbonyl)piperazino]-(4-methyl-2-phenyl-thiazol-5-yl)methanone Formula: C26H31N3O2S MolecularWeight: 449.60824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)N3CCN(CC3)C(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)N3CCN(CC3)C(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C26H31N3O2S/c1-17-22(32-23(27-17)21-5-3-2-4-6-21)24(30)28-7-9-29(10-8-28)25(31)26-14-18-11-19(15-26)13-20(12-18)16-26/h2-6,18-20H,7-16H2,1H3