3-[(3-azanyl-1H-indazol-5-yl)amino]-4-[(3-oxidanylpyridin-4-yl)methylamino]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[(3-azanyl-1H-indazol-5-yl)amino]-4-[(3-oxidanylpyridin-4-yl)methylamino]cyclobut-3-ene-1,2-dione Openeye Name: 3-[(3-amino-1H-indazol-5-yl)amino]-4-[(3-hydroxy-4-pyridyl)methylamino]cyclobut-3-ene-1,2-dione CAS Name: 3-[(3-amino-1H-indazol-5-yl)amino]-4-[(3-hydroxy-4-pyridinyl)methylamino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-[(3-amino-1H-indazol-5-yl)amino]-4-[(3-hydroxypyridin-4-yl)methylamino]cyclobut-3-ene-1,2-dione Traditional Name: 3-[(3-amino-1H-indazol-5-yl)amino]-4-[(3-hydroxy-4-pyridyl)methylamino]cyclobut-3-ene-1,2-quinone Formula: C17H14N6O3 MolecularWeight: 350.33146

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NC3=C(C(=O)C3=O)NCC4=C(C=NC=C4)O)C(=NN2)N

Isomeric SMILES

C1=CC2=C(C=C1NC3=C(C(=O)C3=O)NCC4=C(C=NC=C4)O)C(=NN2)N

InChI

InChI=1S/C17H14N6O3/c18-17-10-5-9(1-2-11(10)22-23-17)21-14-13(15(25)16(14)26)20-6-8-3-4-19-7-12(8)24/h1-5,7,20-21,24H,6H2,(H3,18,22,23)