2-(hydroxymethyl)-N-(4-morpholin-4-ylsulfonylphenyl)piperidine-1-carbothioamide

Systemtic Name: 2-(hydroxymethyl)-N-(4-morpholin-4-ylsulfonylphenyl)piperidine-1-carbothioamide Openeye Name: 2-(hydroxymethyl)-N-(4-morpholinosulfonylphenyl)piperidine-1-carbothioamide CAS Name: 2-(hydroxymethyl)-N-[4-(4-morpholinylsulfonyl)phenyl]-1-piperidinecarbothioamide IUPAC Name: 2-(hydroxymethyl)-N-(4-morpholin-4-ylsulfonylphenyl)piperidine-1-carbothioamide Traditional Name: 2-methylol-N-(4-morpholinosulfonylphenyl)piperidine-1-carbothioamide Formula: C17H25N3O4S2 MolecularWeight: 399.5281

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CO)C(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

C1CCN(C(C1)CO)C(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C17H25N3O4S2/c21-13-15-3-1-2-8-20(15)17(25)18-14-4-6-16(7-5-14)26(22,23)19-9-11-24-12-10-19/h4-7,15,21H,1-3,8-13H2,(H,18,25)