2-(1-adamantyl)-N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-(phenylmethyl)ethanamide Openeye Name: 2-(1-adamantyl)-N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-benzyl-acetamide CAS Name: 2-(1-adamantyl)-N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-(phenylmethyl)acetamide IUPAC Name: 2-(1-adamantyl)-N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-benzylacetamide Traditional Name: 2-(1-adamantyl)-N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-benzyl-acetamide Formula: C27H36N4O3 MolecularWeight: 464.59974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CC=C2)C(=O)CC34CC5CC(C3)CC(C5)C4)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CC=C2)C(=O)CC34CC5CC(C3)CC(C5)C4)N

InChI

InChI=1S/C27H36N4O3/c1-2-3-9-30-24(28)23(25(33)29-26(30)34)31(17-18-7-5-4-6-8-18)22(32)16-27-13-19-10-20(14-27)12-21(11-19)15-27/h4-8,19-21H,2-3,9-17,28H2,1H3,(H,29,33,34)