5-(1-adamantylcarbamoylamino)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(3-morpholin-4-ylpropyl)benzamide

Systemtic Name: 5-(1-adamantylcarbamoylamino)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(3-morpholin-4-ylpropyl)benzamide Openeye Name: 5-(1-adamantylcarbamoylamino)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(3-morpholinopropyl)benzamide CAS Name: 5-[[(1-adamantylamino)-oxomethyl]amino]-2-[4-(2-methoxyphenyl)-1-piperazinyl]-N-[3-(4-morpholinyl)propyl]benzamide IUPAC Name: 5-(1-adamantylcarbamoylamino)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(3-morpholin-4-ylpropyl)benzamide Traditional Name: 5-(1-adamantylcarbamoylamino)-2-[4-(2-methoxyphenyl)piperazino]-N-(3-morpholinopropyl)benzamide Formula: C36H50N6O4 MolecularWeight: 630.82

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)NC45CC6CC(C4)CC(C6)C5)C(=O)NCCCN7CCOCC7

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)NC45CC6CC(C4)CC(C6)C5)C(=O)NCCCN7CCOCC7

InChI

InChI=1S/C36H50N6O4/c1-45-33-6-3-2-5-32(33)42-13-11-41(12-14-42)31-8-7-29(22-30(31)34(43)37-9-4-10-40-15-17-46-18-16-40)38-35(44)39-36-23-26-19-27(24-36)21-28(20-26)25-36/h2-3,5-8,22,26-28H,4,9-21,23-25H2,1H3,(H,37,43)(H2,38,39,44)