3-(1-adamantylcarbamoylamino)-N-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]propanamide

Systemtic Name: 3-(1-adamantylcarbamoylamino)-N-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]propanamide Openeye Name: 3-(1-adamantylcarbamoylamino)-N-[1-[4-(3-pyridylmethoxy)phenyl]ethyl]propanamide CAS Name: 3-[[(1-adamantylamino)-oxomethyl]amino]-N-[1-[4-(3-pyridinylmethoxy)phenyl]ethyl]propanamide IUPAC Name: 3-(1-adamantylcarbamoylamino)-N-[1-[4-(pyridin-3-ylmethoxy)phenyl]ethyl]propanamide Traditional Name: 3-(1-adamantylcarbamoylamino)-N-[1-[4-(3-pyridylmethoxy)phenyl]ethyl]propionamide Formula: C28H36N4O3 MolecularWeight: 476.61044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)OCC2=CN=CC=C2)NC(=O)CCNC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C1=CC=C(C=C1)OCC2=CN=CC=C2)NC(=O)CCNC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C28H36N4O3/c1-19(24-4-6-25(7-5-24)35-18-20-3-2-9-29-17-20)31-26(33)8-10-30-27(34)32-28-14-21-11-22(15-28)13-23(12-21)16-28/h2-7,9,17,19,21-23H,8,10-16,18H2,1H3,(H,31,33)(H2,30,32,34)