N-[(3-acetamidophenyl)methyl]-3-(1-adamantylcarbamoylamino)propanamide

Systemtic Name: N-[(3-acetamidophenyl)methyl]-3-(1-adamantylcarbamoylamino)propanamide Openeye Name: N-[(3-acetamidophenyl)methyl]-3-(1-adamantylcarbamoylamino)propanamide CAS Name: N-[(3-acetamidophenyl)methyl]-3-[[(1-adamantylamino)-oxomethyl]amino]propanamide IUPAC Name: N-[(3-acetamidophenyl)methyl]-3-(1-adamantylcarbamoylamino)propanamide Traditional Name: N-(3-acetamidobenzyl)-3-(1-adamantylcarbamoylamino)propionamide Formula: C23H32N4O3 MolecularWeight: 412.52518

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)CNC(=O)CCNC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)CNC(=O)CCNC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C23H32N4O3/c1-15(28)26-20-4-2-3-16(10-20)14-25-21(29)5-6-24-22(30)27-23-11-17-7-18(12-23)9-19(8-17)13-23/h2-4,10,17-19H,5-9,11-14H2,1H3,(H,25,29)(H,26,28)(H2,24,27,30)