[2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)amino]-2-oxidanylidene-ethyl]-bis(thiophen-2-ylmethyl)azanium

Systemtic Name: [2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)amino]-2-oxidanylidene-ethyl]-bis(thiophen-2-ylmethyl)azanium Openeye Name: [2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)amino]-2-oxo-ethyl]-bis(2-thienylmethyl)ammonium CAS Name: [2-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)amino]-2-oxoethyl]-bis(thiophen-2-ylmethyl)ammonium IUPAC Name: [2-[(3,5-dimethyl-1-phenylpyrazol-4-yl)amino]-2-oxoethyl]-bis(thiophen-2-ylmethyl)azanium Traditional Name: [2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)amino]-2-keto-ethyl]-bis(2-thenyl)ammonium Formula: C23H25N4OS2+ MolecularWeight: 437.6008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)C[NH+](CC3=CC=CS3)CC4=CC=CS4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)C[NH+](CC3=CC=CS3)CC4=CC=CS4

InChI

InChI=1S/C23H24N4OS2/c1-17-23(18(2)27(25-17)19-8-4-3-5-9-19)24-22(28)16-26(14-20-10-6-12-29-20)15-21-11-7-13-30-21/h3-13H,14-16H2,1-2H3,(H,24,28)/p+1