(2R)-N-(3-methylsulfanylphenyl)-2-(2-morpholin-4-ium-4-ylethyl)piperidine-1-carbothioamide

Systemtic Name: (2R)-N-(3-methylsulfanylphenyl)-2-(2-morpholin-4-ium-4-ylethyl)piperidine-1-carbothioamide Openeye Name: (2R)-N-(3-methylsulfanylphenyl)-2-(2-morpholin-4-ium-4-ylethyl)piperidine-1-carbothioamide CAS Name: (2R)-N-[3-(methylthio)phenyl]-2-[2-(4-morpholin-4-iumyl)ethyl]-1-piperidinecarbothioamide IUPAC Name: (2R)-N-(3-methylsulfanylphenyl)-2-(2-morpholin-4-ium-4-ylethyl)piperidine-1-carbothioamide Traditional Name: (2R)-N-[3-(methylthio)phenyl]-2-(2-morpholin-4-ium-4-ylethyl)piperidine-1-carbothioamide Formula: C19H30N3OS2+ MolecularWeight: 380.591

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=S)N2CCCCC2CC[NH+]3CCOCC3

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=S)N2CCCC[C@@H]2CC[NH+]3CCOCC3

InChI

InChI=1S/C19H29N3OS2/c1-25-18-7-4-5-16(15-18)20-19(24)22-9-3-2-6-17(22)8-10-21-11-13-23-14-12-21/h4-5,7,15,17H,2-3,6,8-14H2,1H3,(H,20,24)/p+1/t17-/m1/s1