2-[1-adamantylcarbamoyl(butan-2-yl)amino]-N-(furan-2-ylmethyl)-N-[(1-methylpyrrol-2-yl)methyl]ethanamide

Systemtic Name: 2-[1-adamantylcarbamoyl(butan-2-yl)amino]-N-(furan-2-ylmethyl)-N-[(1-methylpyrrol-2-yl)methyl]ethanamide Openeye Name: 2-[1-adamantylcarbamoyl(sec-butyl)amino]-N-(2-furylmethyl)-N-[(1-methylpyrrol-2-yl)methyl]acetamide CAS Name: 2-[[(1-adamantylamino)-oxomethyl]-butan-2-ylamino]-N-(2-furanylmethyl)-N-[(1-methyl-2-pyrrolyl)methyl]acetamide IUPAC Name: 2-[1-adamantylcarbamoyl(butan-2-yl)amino]-N-(furan-2-ylmethyl)-N-[(1-methylpyrrol-2-yl)methyl]acetamide Traditional Name: 2-[1-adamantylcarbamoyl(sec-butyl)amino]-N-(2-furfuryl)-N-[(1-methylpyrrol-2-yl)methyl]acetamide Formula: C28H40N4O3 MolecularWeight: 480.6422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC(=O)N(CC1=CC=CN1C)CC2=CC=CO2)C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCC(C)N(CC(=O)N(CC1=CC=CN1C)CC2=CC=CO2)C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C28H40N4O3/c1-4-20(2)32(27(34)29-28-14-21-11-22(15-28)13-23(12-21)16-28)19-26(33)31(18-25-8-6-10-35-25)17-24-7-5-9-30(24)3/h5-10,20-23H,4,11-19H2,1-3H3,(H,29,34)