ethyl 4-[2-[3-azanyl-5-(methylsulfonylamino)pyrazol-4-ylidene]hydrazinyl]benzoate

Systemtic Name: ethyl 4-[2-[3-azanyl-5-(methylsulfonylamino)pyrazol-4-ylidene]hydrazinyl]benzoate Openeye Name: ethyl 4-[2-[3-amino-5-(methanesulfonamido)pyrazol-4-ylidene]hydrazino]benzoate CAS Name: 4-[2-[3-amino-5-(methanesulfonamido)-4-pyrazolylidene]hydrazinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-[3-amino-5-(methanesulfonamido)pyrazol-4-ylidene]hydrazinyl]benzoate Traditional Name: 4-[N'-[3-amino-5-(methanesulfonamido)pyrazol-4-ylidene]hydrazino]benzoic acid ethyl ester Formula: C13H16N6O4S MolecularWeight: 352.36894

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NN=C2C(=NN=C2NS(=O)(=O)C)N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NN=C2C(=NN=C2NS(=O)(=O)C)N

InChI

InChI=1S/C13H16N6O4S/c1-3-23-13(20)8-4-6-9(7-5-8)15-16-10-11(14)17-18-12(10)19-24(2,21)22/h4-7,15H,3H2,1-2H3,(H3,14,16,17,18,19)