3-[(5-bromanylpyridin-3-yl)amino]-4-(1-phenylethylamino)cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[(5-bromanylpyridin-3-yl)amino]-4-(1-phenylethylamino)cyclobut-3-ene-1,2-dione Openeye Name: 3-[(5-bromo-3-pyridyl)amino]-4-(1-phenylethylamino)cyclobut-3-ene-1,2-dione CAS Name: 3-[(5-bromo-3-pyridinyl)amino]-4-(1-phenylethylamino)cyclobut-3-ene-1,2-dione IUPAC Name: 3-[(5-bromopyridin-3-yl)amino]-4-(1-phenylethylamino)cyclobut-3-ene-1,2-dione Traditional Name: 3-[(5-bromo-3-pyridyl)amino]-4-(1-phenylethylamino)cyclobut-3-ene-1,2-quinone Formula: C17H14BrN3O2 MolecularWeight: 372.21596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=C(C(=O)C2=O)NC3=CC(=CN=C3)Br

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=C(C(=O)C2=O)NC3=CC(=CN=C3)Br

InChI

InChI=1S/C17H14BrN3O2/c1-10(11-5-3-2-4-6-11)20-14-15(17(23)16(14)22)21-13-7-12(18)8-19-9-13/h2-10,20-21H,1H3