butyl-bis[(4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium

Systemtic Name: butyl-bis[(4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Openeye Name: butyl-bis[(4-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl]ammonium CAS Name: butyl-bis[(4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]ammonium IUPAC Name: butyl-bis[(4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Traditional Name: butyl-bis[(4-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl]ammonium Formula: C12H22N7S2+ MolecularWeight: 328.47998

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CN1C(=S)N(C=N1)C)CN2C(=S)N(C=N2)C

Isomeric SMILES

CCCC[NH+](CN1C(=S)N(C=N1)C)CN2C(=S)N(C=N2)C

InChI

InChI=1S/C12H21N7S2/c1-4-5-6-17(9-18-11(20)15(2)7-13-18)10-19-12(21)16(3)8-14-19/h7-8H,4-6,9-10H2,1-3H3/p+1