1-(1-adamantyl)-3-[1-(3-methoxypropylcarbamothioyl)piperidin-4-yl]urea

Systemtic Name: 1-(1-adamantyl)-3-[1-(3-methoxypropylcarbamothioyl)piperidin-4-yl]urea Openeye Name: 1-(1-adamantyl)-3-[1-(3-methoxypropylcarbamothioyl)-4-piperidyl]urea CAS Name: 1-(1-adamantyl)-3-[1-[(3-methoxypropylamino)-sulfanylidenemethyl]-4-piperidinyl]urea IUPAC Name: 1-(1-adamantyl)-3-[1-(3-methoxypropylcarbamothioyl)piperidin-4-yl]urea Traditional Name: 1-(1-adamantyl)-3-[1-(3-methoxypropylthiocarbamoyl)-4-piperidyl]urea Formula: C21H36N4O2S MolecularWeight: 408.60114

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=S)N1CCC(CC1)NC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COCCCNC(=S)N1CCC(CC1)NC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H36N4O2S/c1-27-8-2-5-22-20(28)25-6-3-18(4-7-25)23-19(26)24-21-12-15-9-16(13-21)11-17(10-15)14-21/h15-18H,2-14H2,1H3,(H,22,28)(H2,23,24,26)