2-[1-adamantylcarbamoyl(propan-2-yl)amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[1-adamantylcarbamoyl(propan-2-yl)amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[1-adamantylcarbamoyl(isopropyl)amino]-N-benzyl-N-(2-thienylmethyl)acetamide CAS Name: 2-[[(1-adamantylamino)-oxomethyl]-propan-2-ylamino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[1-adamantylcarbamoyl(propan-2-yl)amino]-N-benzyl-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[1-adamantylcarbamoyl(isopropyl)amino]-N-benzyl-N-(2-thenyl)acetamide Formula: C28H37N3O2S MolecularWeight: 479.67728

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H37N3O2S/c1-20(2)31(27(33)29-28-14-22-11-23(15-28)13-24(12-22)16-28)19-26(32)30(18-25-9-6-10-34-25)17-21-7-4-3-5-8-21/h3-10,20,22-24H,11-19H2,1-2H3,(H,29,33)