N-[4-[[3,5-bis(azanyl)-1-phenyl-pyrazol-4-yl]methylideneamino]phenyl]sulfonylethanamide

Systemtic Name: N-[4-[[3,5-bis(azanyl)-1-phenyl-pyrazol-4-yl]methylideneamino]phenyl]sulfonylethanamide Openeye Name: N-[4-[(3,5-diamino-1-phenyl-pyrazol-4-yl)methyleneamino]phenyl]sulfonylacetamide CAS Name: N-[4-[(3,5-diamino-1-phenyl-4-pyrazolyl)methylideneamino]phenyl]sulfonylacetamide IUPAC Name: N-[4-[(3,5-diamino-1-phenylpyrazol-4-yl)methylideneamino]phenyl]sulfonylacetamide Traditional Name: N-[4-[(3,5-diamino-1-phenyl-pyrazol-4-yl)methyleneamino]phenyl]sulfonylacetamide Formula: C18H18N6O3S MolecularWeight: 398.43892

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NS(=O)(=O)C1=CC=C(C=C1)N=CC2=C(N(N=C2N)C3=CC=CC=C3)N

Isomeric SMILES

CC(=O)NS(=O)(=O)C1=CC=C(C=C1)N=CC2=C(N(N=C2N)C3=CC=CC=C3)N

InChI

InChI=1S/C18H18N6O3S/c1-12(25)23-28(26,27)15-9-7-13(8-10-15)21-11-16-17(19)22-24(18(16)20)14-5-3-2-4-6-14/h2-11H,20H2,1H3,(H2,19,22)(H,23,25)