[1-[1-(2-azanylethanoyl)-2-cyano-pyrrolidin-2-yl]-2-adamantyl] N-cyclohexylcarbamate

Systemtic Name: [1-[1-(2-azanylethanoyl)-2-cyano-pyrrolidin-2-yl]-2-adamantyl] N-cyclohexylcarbamate Openeye Name: [1-[1-(2-aminoacetyl)-2-cyano-pyrrolidin-2-yl]-2-adamantyl] N-cyclohexylcarbamate CAS Name: N-cyclohexylcarbamic acid [1-[1-(2-amino-1-oxoethyl)-2-cyano-2-pyrrolidinyl]-2-adamantyl] ester IUPAC Name: [1-[1-(2-aminoacetyl)-2-cyanopyrrolidin-2-yl]-2-adamantyl] N-cyclohexylcarbamate Traditional Name: N-cyclohexylcarbamic acid [1-(2-cyano-1-glycyl-pyrrolidin-2-yl)-2-adamantyl] ester Formula: C24H36N4O3 MolecularWeight: 428.56764

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)OC2C3CC4CC(C3)CC2(C4)C5(CCCN5C(=O)CN)C#N

Isomeric SMILES

C1CCC(CC1)NC(=O)OC2C3CC4CC(C3)CC2(C4)C5(CCCN5C(=O)CN)C#N

InChI

InChI=1S/C24H36N4O3/c25-14-20(29)28-8-4-7-24(28,15-26)23-12-16-9-17(13-23)11-18(10-16)21(23)31-22(30)27-19-5-2-1-3-6-19/h16-19,21H,1-14,25H2,(H,27,30)