[2-(tert-butylamino)-2-oxidanylidene-ethyl]-methyl-[(3-methyl-2-sulfanylidene-benzimidazol-1-yl)methyl]azanium

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl]-methyl-[(3-methyl-2-sulfanylidene-benzimidazol-1-yl)methyl]azanium Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl]-methyl-[(3-methyl-2-thioxo-benzimidazol-1-yl)methyl]ammonium CAS Name: [2-(tert-butylamino)-2-oxoethyl]-methyl-[(3-methyl-2-sulfanylidene-1-benzimidazolyl)methyl]ammonium IUPAC Name: [2-(tert-butylamino)-2-oxoethyl]-methyl-[(3-methyl-2-sulfanylidenebenzimidazol-1-yl)methyl]azanium Traditional Name: [2-(tert-butylamino)-2-keto-ethyl]-methyl-[(3-methyl-2-thioxo-benzimidazol-1-yl)methyl]ammonium Formula: C16H25N4OS+ MolecularWeight: 321.4609

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C[NH+](C)CN1C2=CC=CC=C2N(C1=S)C

Isomeric SMILES

CC(C)(C)NC(=O)C[NH+](C)CN1C2=CC=CC=C2N(C1=S)C

InChI

InChI=1S/C16H24N4OS/c1-16(2,3)17-14(21)10-18(4)11-20-13-9-7-6-8-12(13)19(5)15(20)22/h6-9H,10-11H2,1-5H3,(H,17,21)/p+1