N-(4-cyano-1-methyl-piperidin-4-yl)-3-cyclohexyl-2-(morpholin-4-ylcarbothioylamino)propanamide

Systemtic Name: N-(4-cyano-1-methyl-piperidin-4-yl)-3-cyclohexyl-2-(morpholin-4-ylcarbothioylamino)propanamide Openeye Name: N-(4-cyano-1-methyl-4-piperidyl)-3-cyclohexyl-2-(morpholine-4-carbothioylamino)propanamide CAS Name: N-(4-cyano-1-methyl-4-piperidinyl)-3-cyclohexyl-2-[[4-morpholinyl(sulfanylidene)methyl]amino]propanamide IUPAC Name: N-(4-cyano-1-methylpiperidin-4-yl)-3-cyclohexyl-2-(morpholine-4-carbothioylamino)propanamide Traditional Name: N-(4-cyano-1-methyl-4-piperidyl)-3-cyclohexyl-2-(morpholine-4-carbothioylamino)propionamide Formula: C21H35N5O2S MolecularWeight: 421.5999

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)(C#N)NC(=O)C(CC2CCCCC2)NC(=S)N3CCOCC3

Isomeric SMILES

CN1CCC(CC1)(C#N)NC(=O)C(CC2CCCCC2)NC(=S)N3CCOCC3

InChI

InChI=1S/C21H35N5O2S/c1-25-9-7-21(16-22,8-10-25)24-19(27)18(15-17-5-3-2-4-6-17)23-20(29)26-11-13-28-14-12-26/h17-18H,2-15H2,1H3,(H,23,29)(H,24,27)