N-[4-[[(E)-(3-azanyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]amino]phenyl]sulfonylethanamide

Systemtic Name: N-[4-[[(E)-(3-azanyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]amino]phenyl]sulfonylethanamide Openeye Name: N-[4-[[(E)-(3-amino-5-oxo-1-phenyl-pyrazol-4-ylidene)methyl]amino]phenyl]sulfonylacetamide CAS Name: N-[4-[[(E)-(3-amino-5-oxo-1-phenyl-4-pyrazolylidene)methyl]amino]phenyl]sulfonylacetamide IUPAC Name: N-[4-[[(E)-(3-amino-5-oxo-1-phenylpyrazol-4-ylidene)methyl]amino]phenyl]sulfonylacetamide Traditional Name: N-[4-[[(E)-(3-amino-5-keto-1-phenyl-2-pyrazolin-4-ylidene)methyl]amino]phenyl]sulfonylacetamide Formula: C18H17N5O4S MolecularWeight: 399.42368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NS(=O)(=O)C1=CC=C(C=C1)NC=C2C(=NN(C2=O)C3=CC=CC=C3)N

Isomeric SMILES

CC(=O)NS(=O)(=O)C1=CC=C(C=C1)N/C=C/2\C(=NN(C2=O)C3=CC=CC=C3)N

InChI

InChI=1S/C18H17N5O4S/c1-12(24)22-28(26,27)15-9-7-13(8-10-15)20-11-16-17(19)21-23(18(16)25)14-5-3-2-4-6-14/h2-11,20H,1H3,(H2,19,21)(H,22,24)/b16-11+