(2R)-3-[3-(4-methylpiperidin-1-ium-1-yl)propylimino]-2-(4-methyl-1,3-thiazol-2-yl)propanenitrile

Systemtic Name: (2R)-3-[3-(4-methylpiperidin-1-ium-1-yl)propylimino]-2-(4-methyl-1,3-thiazol-2-yl)propanenitrile Openeye Name: (2R)-3-[3-(4-methylpiperidin-1-ium-1-yl)propylimino]-2-(4-methylthiazol-2-yl)propanenitrile CAS Name: (2R)-3-[3-(4-methyl-1-piperidin-1-iumyl)propylimino]-2-(4-methyl-2-thiazolyl)propanenitrile IUPAC Name: (2R)-3-[3-(4-methylpiperidin-1-ium-1-yl)propylimino]-2-(4-methyl-1,3-thiazol-2-yl)propanenitrile Traditional Name: (2R)-3-[3-(4-methylpiperidin-1-ium-1-yl)propylimino]-2-(4-methylthiazol-2-yl)propionitrile Formula: C16H25N4S+ MolecularWeight: 305.4615

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCCN=CC(C#N)C2=NC(=CS2)C

Isomeric SMILES

CC1CC[NH+](CC1)CCCN=C[C@H](C#N)C2=NC(=CS2)C

InChI

InChI=1S/C16H24N4S/c1-13-4-8-20(9-5-13)7-3-6-18-11-15(10-17)16-19-14(2)12-21-16/h11-13,15H,3-9H2,1-2H3/p+1/t15-/m0/s1