2-[1-adamantylcarbamoyl(cyclopropyl)amino]-N-[(1-methylpyrrol-2-yl)methyl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[1-adamantylcarbamoyl(cyclopropyl)amino]-N-[(1-methylpyrrol-2-yl)methyl]-N-(phenylmethyl)ethanamide Openeye Name: 2-[1-adamantylcarbamoyl(cyclopropyl)amino]-N-benzyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide CAS Name: 2-[[(1-adamantylamino)-oxomethyl]-cyclopropylamino]-N-[(1-methyl-2-pyrrolyl)methyl]-N-(phenylmethyl)acetamide IUPAC Name: 2-[1-adamantylcarbamoyl(cyclopropyl)amino]-N-benzyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide Traditional Name: 2-[1-adamantylcarbamoyl(cyclopropyl)amino]-N-benzyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide Formula: C29H38N4O2 MolecularWeight: 474.63762

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1CN(CC2=CC=CC=C2)C(=O)CN(C3CC3)C(=O)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CN1C=CC=C1CN(CC2=CC=CC=C2)C(=O)CN(C3CC3)C(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C29H38N4O2/c1-31-11-5-8-26(31)19-32(18-21-6-3-2-4-7-21)27(34)20-33(25-9-10-25)28(35)30-29-15-22-12-23(16-29)14-24(13-22)17-29/h2-8,11,22-25H,9-10,12-20H2,1H3,(H,30,35)