3-[[3-[[3-(diazanylmethylideneamino)phenyl]carbonylamino]phenyl]sulfonylamino]-3-pyridin-3-yl-propanoic acid

Systemtic Name: 3-[[3-[[3-(diazanylmethylideneamino)phenyl]carbonylamino]phenyl]sulfonylamino]-3-pyridin-3-yl-propanoic acid Openeye Name: 3-[[3-[[3-(hydrazinomethyleneamino)benzoyl]amino]phenyl]sulfonylamino]-3-(3-pyridyl)propanoic acid CAS Name: 3-[[3-[[[3-(hydrazinylmethylideneamino)phenyl]-oxomethyl]amino]phenyl]sulfonylamino]-3-(3-pyridinyl)propanoic acid IUPAC Name: 3-[[3-[[3-(hydrazinylmethylideneamino)benzoyl]amino]phenyl]sulfonylamino]-3-pyridin-3-ylpropanoic acid Traditional Name: 3-[[3-[[3-(hydrazinomethyleneamino)benzoyl]amino]phenyl]sulfonylamino]-3-(3-pyridyl)propionic acid Formula: C22H22N6O5S MolecularWeight: 482.51228

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N=CNN)C(=O)NC2=CC(=CC=C2)S(=O)(=O)NC(CC(=O)O)C3=CN=CC=C3

Isomeric SMILES

C1=CC(=CC(=C1)N=CNN)C(=O)NC2=CC(=CC=C2)S(=O)(=O)NC(CC(=O)O)C3=CN=CC=C3

InChI

InChI=1S/C22H22N6O5S/c23-26-14-25-17-6-1-4-15(10-17)22(31)27-18-7-2-8-19(11-18)34(32,33)28-20(12-21(29)30)16-5-3-9-24-13-16/h1-11,13-14,20,28H,12,23H2,(H,25,26)(H,27,31)(H,29,30)