2-[1-adamantylcarbamoyl(2-morpholin-4-ylethyl)amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[1-adamantylcarbamoyl(2-morpholin-4-ylethyl)amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[1-adamantylcarbamoyl(2-morpholinoethyl)amino]-N-benzyl-N-(2-thienylmethyl)acetamide CAS Name: 2-[[(1-adamantylamino)-oxomethyl]-[2-(4-morpholinyl)ethyl]amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[1-adamantylcarbamoyl(2-morpholin-4-ylethyl)amino]-N-benzyl-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[1-adamantylcarbamoyl(2-morpholinoethyl)amino]-N-benzyl-N-(2-thenyl)acetamide Formula: C31H42N4O3S MolecularWeight: 550.75518

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCN(CC(=O)N(CC2=CC=CC=C2)CC3=CC=CS3)C(=O)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1COCCN1CCN(CC(=O)N(CC2=CC=CC=C2)CC3=CC=CS3)C(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C31H42N4O3S/c36-29(35(22-28-7-4-14-39-28)21-24-5-2-1-3-6-24)23-34(9-8-33-10-12-38-13-11-33)30(37)32-31-18-25-15-26(19-31)17-27(16-25)20-31/h1-7,14,25-27H,8-13,15-23H2,(H,32,37)