[4-[[1-[(E)-3-acetamido-3-methyl-but-1-enyl]-5-propan-2-yloxy-pyrazol-4-yl]carbonylamino]-1-adamantyl] carbamate

Systemtic Name: [4-[[1-[(E)-3-acetamido-3-methyl-but-1-enyl]-5-propan-2-yloxy-pyrazol-4-yl]carbonylamino]-1-adamantyl] carbamate Openeye Name: [4-[[1-[(E)-3-acetamido-3-methyl-but-1-enyl]-5-isopropoxy-pyrazole-4-carbonyl]amino]-1-adamantyl] carbamate CAS Name: carbamic acid [4-[[[1-[(E)-3-acetamido-3-methylbut-1-enyl]-5-propan-2-yloxy-4-pyrazolyl]-oxomethyl]amino]-1-adamantyl] ester IUPAC Name: [4-[[1-[(E)-3-acetamido-3-methylbut-1-enyl]-5-propan-2-yloxypyrazole-4-carbonyl]amino]-1-adamantyl] carbamate Traditional Name: carbamic acid [4-[[1-[(E)-3-acetamido-3-methyl-but-1-enyl]-5-isopropoxy-pyrazole-4-carbonyl]amino]-1-adamantyl] ester Formula: C25H37N5O5 MolecularWeight: 487.59178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=NN1C=CC(C)(C)NC(=O)C)C(=O)NC2C3CC4CC2CC(C4)(C3)OC(=O)N

Isomeric SMILES

CC(C)OC1=C(C=NN1/C=C/C(C)(C)NC(=O)C)C(=O)NC2C3CC4CC2CC(C4)(C3)OC(=O)N

InChI

InChI=1S/C25H37N5O5/c1-14(2)34-22-19(13-27-30(22)7-6-24(4,5)29-15(3)31)21(32)28-20-17-8-16-9-18(20)12-25(10-16,11-17)35-23(26)33/h6-7,13-14,16-18,20H,8-12H2,1-5H3,(H2,26,33)(H,28,32)(H,29,31)/b7-6+