methyl-[(1-phenylpyrazol-4-yl)methyl]-[(5-propylsulfanyl-2-sulfanylidene-1,3,4-thiadiazol-3-yl)methyl]azanium

Systemtic Name: methyl-[(1-phenylpyrazol-4-yl)methyl]-[(5-propylsulfanyl-2-sulfanylidene-1,3,4-thiadiazol-3-yl)methyl]azanium Openeye Name: methyl-[(1-phenylpyrazol-4-yl)methyl]-[(5-propylsulfanyl-2-thioxo-1,3,4-thiadiazol-3-yl)methyl]ammonium CAS Name: methyl-[(1-phenyl-4-pyrazolyl)methyl]-[[5-(propylthio)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]ammonium IUPAC Name: methyl-[(1-phenylpyrazol-4-yl)methyl]-[(5-propylsulfanyl-2-sulfanylidene-1,3,4-thiadiazol-3-yl)methyl]azanium Traditional Name: methyl-[(1-phenylpyrazol-4-yl)methyl]-[[5-(propylthio)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl]ammonium Formula: C17H22N5S3+ MolecularWeight: 392.58508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN(C(=S)S1)C[NH+](C)CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CCCSC1=NN(C(=S)S1)C[NH+](C)CC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C17H21N5S3/c1-3-9-24-16-19-22(17(23)25-16)13-20(2)11-14-10-18-21(12-14)15-7-5-4-6-8-15/h4-8,10,12H,3,9,11,13H2,1-2H3/p+1