N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-N-(3-methoxypropyl)adamantane-1-carboxamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-N-(3-methoxypropyl)adamantane-1-carboxamide Openeye Name: N-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-N-(3-methoxypropyl)adamantane-1-carboxamide CAS Name: N-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-N-(3-methoxypropyl)-1-adamantanecarboxamide IUPAC Name: N-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-N-(3-methoxypropyl)adamantane-1-carboxamide Traditional Name: N-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-N-(3-methoxypropyl)adamantane-1-carboxamide Formula: C26H34N4O4 MolecularWeight: 466.57256

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COCCCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H34N4O4/c1-34-9-5-8-29(24(32)26-13-18-10-19(14-26)12-20(11-18)15-26)21-22(27)30(25(33)28-23(21)31)16-17-6-3-2-4-7-17/h2-4,6-7,18-20H,5,8-16,27H2,1H3,(H,28,31,33)