N-[1-(2-methylpropylcarbamothioyl)piperidin-4-yl]adamantane-1-carboxamide

Systemtic Name: N-[1-(2-methylpropylcarbamothioyl)piperidin-4-yl]adamantane-1-carboxamide Openeye Name: N-[1-(isobutylcarbamothioyl)-4-piperidyl]adamantane-1-carboxamide CAS Name: N-[1-[(2-methylpropylamino)-sulfanylidenemethyl]-4-piperidinyl]-1-adamantanecarboxamide IUPAC Name: N-[1-(2-methylpropylcarbamothioyl)piperidin-4-yl]adamantane-1-carboxamide Traditional Name: N-[1-(isobutylthiocarbamoyl)-4-piperidyl]adamantane-1-carboxamide Formula: C21H35N3OS MolecularWeight: 377.5871

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=S)N1CCC(CC1)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)CNC(=S)N1CCC(CC1)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H35N3OS/c1-14(2)13-22-20(26)24-5-3-18(4-6-24)23-19(25)21-10-15-7-16(11-21)9-17(8-15)12-21/h14-18H,3-13H2,1-2H3,(H,22,26)(H,23,25)