2-(4-tert-butyl-1,3-thiazol-3-ium-2-yl)ethanenitrile

Systemtic Name: 2-(4-tert-butyl-1,3-thiazol-3-ium-2-yl)ethanenitrile Openeye Name: 2-(4-tert-butylthiazol-3-ium-2-yl)acetonitrile CAS Name: 2-(4-tert-butyl-2-thiazol-3-iumyl)acetonitrile IUPAC Name: 2-(4-tert-butyl-1,3-thiazol-3-ium-2-yl)acetonitrile Traditional Name: 2-(4-tert-butylthiazol-3-ium-2-yl)acetonitrile Formula: C9H13N2S+ MolecularWeight: 181.27792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=[NH+]1)CC#N

Isomeric SMILES

CC(C)(C)C1=CSC(=[NH+]1)CC#N

InChI

InChI=1S/C9H12N2S/c1-9(2,3)7-6-12-8(11-7)4-5-10/h6H,4H2,1-3H3/p+1