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

Systemtic Name: 3-(1-adamantylcarbamoylamino)-N-[6-azanyl-1-(2-methylpropyl)-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-propanamide Openeye Name: 3-(1-adamantylcarbamoylamino)-N-(6-amino-1-isobutyl-2,4-dioxo-pyrimidin-5-yl)-N-butyl-propanamide CAS Name: 3-[[(1-adamantylamino)-oxomethyl]amino]-N-[6-amino-1-(2-methylpropyl)-2,4-dioxo-5-pyrimidinyl]-N-butylpropanamide IUPAC Name: 3-(1-adamantylcarbamoylamino)-N-[6-amino-1-(2-methylpropyl)-2,4-dioxopyrimidin-5-yl]-N-butylpropanamide Traditional Name: 3-(1-adamantylcarbamoylamino)-N-(6-amino-1-isobutyl-2,4-diketo-pyrimidin-5-yl)-N-butyl-propionamide Formula: C26H42N6O4 MolecularWeight: 502.64948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H42N6O4/c1-4-5-8-31(21-22(27)32(15-16(2)3)25(36)29-23(21)34)20(33)6-7-28-24(35)30-26-12-17-9-18(13-26)11-19(10-17)14-26/h16-19H,4-15,27H2,1-3H3,(H2,28,30,35)(H,29,34,36)