1-[2-(1-adamantyl)ethyl]-3-[(2R)-2-methyl-3-pyridin-4-yl-propyl]-1-pentyl-urea

Systemtic Name: 1-[2-(1-adamantyl)ethyl]-3-[(2R)-2-methyl-3-pyridin-4-yl-propyl]-1-pentyl-urea Openeye Name: 1-[2-(1-adamantyl)ethyl]-3-[(2R)-2-methyl-3-(4-pyridyl)propyl]-1-pentyl-urea CAS Name: 1-[2-(1-adamantyl)ethyl]-3-[(2R)-2-methyl-3-pyridin-4-ylpropyl]-1-pentylurea IUPAC Name: 1-[2-(1-adamantyl)ethyl]-3-[(2R)-2-methyl-3-pyridin-4-ylpropyl]-1-pentylurea Traditional Name: 1-[2-(1-adamantyl)ethyl]-1-amyl-3-[(2R)-2-methyl-3-(4-pyridyl)propyl]urea Formula: C27H43N3O MolecularWeight: 425.64982

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCC12CC3CC(C1)CC(C3)C2)C(=O)NCC(C)CC4=CC=NC=C4

Isomeric SMILES

CCCCCN(CCC12CC3CC(C1)CC(C3)C2)C(=O)NC[C@H](C)CC4=CC=NC=C4

InChI

InChI=1S/C27H43N3O/c1-3-4-5-11-30(26(31)29-20-21(2)13-22-6-9-28-10-7-22)12-8-27-17-23-14-24(18-27)16-25(15-23)19-27/h6-7,9-10,21,23-25H,3-5,8,11-20H2,1-2H3,(H,29,31)/t21-,23?,24?,25?,27?/m1/s1