3-[1-adamantylcarbamoyl(1-phenylethyl)amino]-N-(4-ethylphenyl)propanamide

Systemtic Name: 3-[1-adamantylcarbamoyl(1-phenylethyl)amino]-N-(4-ethylphenyl)propanamide Openeye Name: 3-[1-adamantylcarbamoyl(1-phenylethyl)amino]-N-(4-ethylphenyl)propanamide CAS Name: 3-[[(1-adamantylamino)-oxomethyl]-(1-phenylethyl)amino]-N-(4-ethylphenyl)propanamide IUPAC Name: 3-[1-adamantylcarbamoyl(1-phenylethyl)amino]-N-(4-ethylphenyl)propanamide Traditional Name: 3-[1-adamantylcarbamoyl(1-phenylethyl)amino]-N-(4-ethylphenyl)propionamide Formula: C30H39N3O2 MolecularWeight: 473.64956

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)CCN(C(C)C2=CC=CC=C2)C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)CCN(C(C)C2=CC=CC=C2)C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C30H39N3O2/c1-3-22-9-11-27(12-10-22)31-28(34)13-14-33(21(2)26-7-5-4-6-8-26)29(35)32-30-18-23-15-24(19-30)17-25(16-23)20-30/h4-12,21,23-25H,3,13-20H2,1-2H3,(H,31,34)(H,32,35)