2-[1-adamantylcarbamoyl(3-methoxypropyl)amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[1-adamantylcarbamoyl(3-methoxypropyl)amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[1-adamantylcarbamoyl(3-methoxypropyl)amino]-N-benzyl-N-(2-thienylmethyl)acetamide CAS Name: 2-[[(1-adamantylamino)-oxomethyl]-(3-methoxypropyl)amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[1-adamantylcarbamoyl(3-methoxypropyl)amino]-N-benzyl-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[1-adamantylcarbamoyl(3-methoxypropyl)amino]-N-benzyl-N-(2-thenyl)acetamide Formula: C29H39N3O3S MolecularWeight: 509.70326

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CS2)C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COCCCN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CS2)C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C29H39N3O3S/c1-35-11-6-10-31(28(34)30-29-16-23-13-24(17-29)15-25(14-23)18-29)21-27(33)32(20-26-9-5-12-36-26)19-22-7-3-2-4-8-22/h2-5,7-9,12,23-25H,6,10-11,13-21H2,1H3,(H,30,34)