3-(1-adamantylcarbamoylamino)-N-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-N-butyl-propanamide

Systemtic Name: 3-(1-adamantylcarbamoylamino)-N-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-N-butyl-propanamide Openeye Name: 3-(1-adamantylcarbamoylamino)-N-(6-amino-2,4-dioxo-1-propyl-pyrimidin-5-yl)-N-butyl-propanamide CAS Name: 3-[[(1-adamantylamino)-oxomethyl]amino]-N-(6-amino-2,4-dioxo-1-propyl-5-pyrimidinyl)-N-butylpropanamide IUPAC Name: 3-(1-adamantylcarbamoylamino)-N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butylpropanamide Traditional Name: 3-(1-adamantylcarbamoylamino)-N-(6-amino-2,4-diketo-1-propyl-pyrimidin-5-yl)-N-butyl-propionamide Formula: C25H40N6O4 MolecularWeight: 488.6229

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)CCNC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)CCNC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C25H40N6O4/c1-3-5-9-30(20-21(26)31(8-4-2)24(35)28-22(20)33)19(32)6-7-27-23(34)29-25-13-16-10-17(14-25)12-18(11-16)15-25/h16-18H,3-15,26H2,1-2H3,(H2,27,29,34)(H,28,33,35)