N-(1-adamantyl)-4-[1-(4-tert-butyl-1,3-thiazol-2-yl)-5-propyl-pyrazol-4-yl]carbonyl-2-methyl-piperazine-1-carboxamide

Systemtic Name: N-(1-adamantyl)-4-[1-(4-tert-butyl-1,3-thiazol-2-yl)-5-propyl-pyrazol-4-yl]carbonyl-2-methyl-piperazine-1-carboxamide Openeye Name: N-(1-adamantyl)-4-[1-(4-tert-butylthiazol-2-yl)-5-propyl-pyrazole-4-carbonyl]-2-methyl-piperazine-1-carboxamide CAS Name: N-(1-adamantyl)-4-[[1-(4-tert-butyl-2-thiazolyl)-5-propyl-4-pyrazolyl]-oxomethyl]-2-methyl-1-piperazinecarboxamide IUPAC Name: N-(1-adamantyl)-4-[1-(4-tert-butyl-1,3-thiazol-2-yl)-5-propylpyrazole-4-carbonyl]-2-methylpiperazine-1-carboxamide Traditional Name: N-(1-adamantyl)-4-[1-(4-tert-butylthiazol-2-yl)-5-propyl-pyrazole-4-carbonyl]-2-methyl-piperazine-1-carboxamide Formula: C30H44N6O2S MolecularWeight: 552.77436

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=NN1C2=NC(=CS2)C(C)(C)C)C(=O)N3CCN(C(C3)C)C(=O)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CCCC1=C(C=NN1C2=NC(=CS2)C(C)(C)C)C(=O)N3CCN(C(C3)C)C(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C30H44N6O2S/c1-6-7-24-23(16-31-36(24)28-32-25(18-39-28)29(3,4)5)26(37)34-8-9-35(19(2)17-34)27(38)33-30-13-20-10-21(14-30)12-22(11-20)15-30/h16,18-22H,6-15,17H2,1-5H3,(H,33,38)