N-(1-adamantyl)-4-[1-(2-methoxyethoxymethyl)imidazol-2-yl]piperidine-1-carbothioamide

Systemtic Name: N-(1-adamantyl)-4-[1-(2-methoxyethoxymethyl)imidazol-2-yl]piperidine-1-carbothioamide Openeye Name: N-(1-adamantyl)-4-[1-(2-methoxyethoxymethyl)imidazol-2-yl]piperidine-1-carbothioamide CAS Name: N-(1-adamantyl)-4-[1-(2-methoxyethoxymethyl)-2-imidazolyl]-1-piperidinecarbothioamide IUPAC Name: N-(1-adamantyl)-4-[1-(2-methoxyethoxymethyl)imidazol-2-yl]piperidine-1-carbothioamide Traditional Name: N-(1-adamantyl)-4-[1-(2-methoxyethoxymethyl)imidazol-2-yl]piperidine-1-carbothioamide Formula: C23H36N4O2S MolecularWeight: 432.62254

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Descriptors Computed from Structure

Canonical SMILES:

COCCOCN1C=CN=C1C2CCN(CC2)C(=S)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COCCOCN1C=CN=C1C2CCN(CC2)C(=S)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H36N4O2S/c1-28-8-9-29-16-27-7-4-24-21(27)20-2-5-26(6-3-20)22(30)25-23-13-17-10-18(14-23)12-19(11-17)15-23/h4,7,17-20H,2-3,5-6,8-16H2,1H3,(H,25,30)