[3-methyl-5-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-pyrazol-4-yl]methylazanium

Systemtic Name: [3-methyl-5-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-pyrazol-4-yl]methylazanium Openeye Name: [3-methyl-5-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-pyrazol-4-yl]methylammonium CAS Name: [3-methyl-5-[(4-methyl-1,2,4-triazol-3-yl)thio]-1-phenyl-4-pyrazolyl]methylammonium IUPAC Name: [3-methyl-5-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-phenylpyrazol-4-yl]methylazanium Traditional Name: [3-methyl-5-[(4-methyl-1,2,4-triazol-3-yl)thio]-1-phenyl-pyrazol-4-yl]methylammonium Formula: C14H17N6S+ MolecularWeight: 301.38998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C[NH3+])SC2=NN=CN2C)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C[NH3+])SC2=NN=CN2C)C3=CC=CC=C3

InChI

InChI=1S/C14H16N6S/c1-10-12(8-15)13(21-14-17-16-9-19(14)2)20(18-10)11-6-4-3-5-7-11/h3-7,9H,8,15H2,1-2H3/p+1