3-[[(1S)-2-methyl-2-oxidanyl-1-phenyl-propyl]amino]-4-(pyridin-4-ylamino)cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[[(1S)-2-methyl-2-oxidanyl-1-phenyl-propyl]amino]-4-(pyridin-4-ylamino)cyclobut-3-ene-1,2-dione Openeye Name: 3-[[(1S)-2-hydroxy-2-methyl-1-phenyl-propyl]amino]-4-(4-pyridylamino)cyclobut-3-ene-1,2-dione CAS Name: 3-[[(1S)-2-hydroxy-2-methyl-1-phenylpropyl]amino]-4-(pyridin-4-ylamino)cyclobut-3-ene-1,2-dione IUPAC Name: 3-[[(1S)-2-hydroxy-2-methyl-1-phenylpropyl]amino]-4-(pyridin-4-ylamino)cyclobut-3-ene-1,2-dione Traditional Name: 3-[[(1S)-2-hydroxy-2-methyl-1-phenyl-propyl]amino]-4-(4-pyridylamino)cyclobut-3-ene-1,2-quinone Formula: C19H19N3O3 MolecularWeight: 337.37246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C1=CC=CC=C1)NC2=C(C(=O)C2=O)NC3=CC=NC=C3)O

Isomeric SMILES

CC(C)([C@H](C1=CC=CC=C1)NC2=C(C(=O)C2=O)NC3=CC=NC=C3)O

InChI

InChI=1S/C19H19N3O3/c1-19(2,25)18(12-6-4-3-5-7-12)22-15-14(16(23)17(15)24)21-13-8-10-20-11-9-13/h3-11,18,22,25H,1-2H3,(H,20,21)/t18-/m0/s1