[5-(tert-butylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl-methyl-(phenylmethyl)azanium

Systemtic Name: [5-(tert-butylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[[5-(tert-butylamino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl]-methyl-ammonium CAS Name: [5-(tert-butylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[5-(tert-butylamino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]-methylazanium Traditional Name: benzyl-[[5-(tert-butylamino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl]-methyl-ammonium Formula: C15H23N4S2+ MolecularWeight: 323.49992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NN(C(=S)S1)C[NH+](C)CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)NC1=NN(C(=S)S1)C[NH+](C)CC2=CC=CC=C2

InChI

InChI=1S/C15H22N4S2/c1-15(2,3)16-13-17-19(14(20)21-13)11-18(4)10-12-8-6-5-7-9-12/h5-9H,10-11H2,1-4H3,(H,16,17)/p+1