2-[[4-(hydroxymethyl)piperidin-1-yl]sulfonylmethyl]benzenecarbothioamide

Systemtic Name: 2-[[4-(hydroxymethyl)piperidin-1-yl]sulfonylmethyl]benzenecarbothioamide Openeye Name: 2-[[4-(hydroxymethyl)-1-piperidyl]sulfonylmethyl]benzenecarbothioamide CAS Name: 2-[[4-(hydroxymethyl)-1-piperidinyl]sulfonylmethyl]benzenecarbothioamide IUPAC Name: 2-[[4-(hydroxymethyl)piperidin-1-yl]sulfonylmethyl]benzenecarbothioamide Traditional Name: 2-[(4-methylolpiperidino)sulfonylmethyl]thiobenzamide Formula: C14H20N2O3S2 MolecularWeight: 328.4502

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CO)S(=O)(=O)CC2=CC=CC=C2C(=S)N

Isomeric SMILES

C1CN(CCC1CO)S(=O)(=O)CC2=CC=CC=C2C(=S)N

InChI

InChI=1S/C14H20N2O3S2/c15-14(20)13-4-2-1-3-12(13)10-21(18,19)16-7-5-11(9-17)6-8-16/h1-4,11,17H,5-10H2,(H2,15,20)