N-(1-adamantylcarbamoyl)-2-[4-[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]propanamide

Systemtic Name: N-(1-adamantylcarbamoyl)-2-[4-[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]propanamide Openeye Name: N-(1-adamantylcarbamoyl)-2-[4-[2-(3,5-dimethyl-1-piperidyl)-2-oxo-ethyl]piperazin-1-yl]propanamide CAS Name: N-[(1-adamantylamino)-oxomethyl]-2-[4-[2-(3,5-dimethyl-1-piperidinyl)-2-oxoethyl]-1-piperazinyl]propanamide IUPAC Name: N-(1-adamantylcarbamoyl)-2-[4-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]propanamide Traditional Name: N-(1-adamantylcarbamoyl)-2-[4-[2-(3,5-dimethylpiperidino)-2-keto-ethyl]piperazino]propionamide Formula: C27H45N5O3 MolecularWeight: 487.6779

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CN2CCN(CC2)C(C)C(=O)NC(=O)NC34CC5CC(C3)CC(C5)C4)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)CN2CCN(CC2)C(C)C(=O)NC(=O)NC34CC5CC(C3)CC(C5)C4)C

InChI

InChI=1S/C27H45N5O3/c1-18-8-19(2)16-32(15-18)24(33)17-30-4-6-31(7-5-30)20(3)25(34)28-26(35)29-27-12-21-9-22(13-27)11-23(10-21)14-27/h18-23H,4-17H2,1-3H3,(H2,28,29,34,35)