3-(tert-butylamino)-4-[(2-chloranylpyridin-3-yl)amino]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-(tert-butylamino)-4-[(2-chloranylpyridin-3-yl)amino]cyclobut-3-ene-1,2-dione Openeye Name: 3-(tert-butylamino)-4-[(2-chloro-3-pyridyl)amino]cyclobut-3-ene-1,2-dione CAS Name: 3-(tert-butylamino)-4-[(2-chloro-3-pyridinyl)amino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-(tert-butylamino)-4-[(2-chloropyridin-3-yl)amino]cyclobut-3-ene-1,2-dione Traditional Name: 3-(tert-butylamino)-4-[(2-chloro-3-pyridyl)amino]cyclobut-3-ene-1,2-quinone Formula: C13H14ClN3O2 MolecularWeight: 279.72216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=C(C(=O)C1=O)NC2=C(N=CC=C2)Cl

Isomeric SMILES

CC(C)(C)NC1=C(C(=O)C1=O)NC2=C(N=CC=C2)Cl

InChI

InChI=1S/C13H14ClN3O2/c1-13(2,3)17-9-8(10(18)11(9)19)16-7-5-4-6-15-12(7)14/h4-6,16-17H,1-3H3