(2R)-2-(1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ium-4-ylethyl)piperidine-1-carbothioamide

Systemtic Name: (2R)-2-(1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ium-4-ylethyl)piperidine-1-carbothioamide Openeye Name: (2R)-2-(1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ium-4-ylethyl)piperidine-1-carbothioamide CAS Name: (2R)-2-(1,3-benzothiazol-2-yl)-N-[2-(4-morpholin-4-iumyl)ethyl]-1-piperidinecarbothioamide IUPAC Name: (2R)-2-(1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ium-4-ylethyl)piperidine-1-carbothioamide Traditional Name: (2R)-2-(1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ium-4-ylethyl)piperidine-1-carbothioamide Formula: C19H27N4OS2+ MolecularWeight: 391.57388

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C2=NC3=CC=CC=C3S2)C(=S)NCC[NH+]4CCOCC4

Isomeric SMILES

C1CCN([C@H](C1)C2=NC3=CC=CC=C3S2)C(=S)NCC[NH+]4CCOCC4

InChI

InChI=1S/C19H26N4OS2/c25-19(20-8-10-22-11-13-24-14-12-22)23-9-4-3-6-16(23)18-21-15-5-1-2-7-17(15)26-18/h1-2,5,7,16H,3-4,6,8-14H2,(H,20,25)/p+1/t16-/m1/s1