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

Systemtic Name: methyl-[(5-methyl-2-sulfanylidene-1,3,4-thiadiazol-3-yl)methyl]-[(1-phenylpyrazol-4-yl)methyl]azanium Openeye Name: methyl-[(5-methyl-2-thioxo-1,3,4-thiadiazol-3-yl)methyl]-[(1-phenylpyrazol-4-yl)methyl]ammonium CAS Name: methyl-[(5-methyl-2-sulfanylidene-1,3,4-thiadiazol-3-yl)methyl]-[(1-phenyl-4-pyrazolyl)methyl]ammonium IUPAC Name: methyl-[(5-methyl-2-sulfanylidene-1,3,4-thiadiazol-3-yl)methyl]-[(1-phenylpyrazol-4-yl)methyl]azanium Traditional Name: methyl-[(5-methyl-2-thioxo-1,3,4-thiadiazol-3-yl)methyl]-[(1-phenylpyrazol-4-yl)methyl]ammonium Formula: C15H18N5S2+ MolecularWeight: 332.46692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=S)S1)C[NH+](C)CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=S)S1)C[NH+](C)CC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C15H17N5S2/c1-12-17-20(15(21)22-12)11-18(2)9-13-8-16-19(10-13)14-6-4-3-5-7-14/h3-8,10H,9,11H2,1-2H3/p+1