N2-[1,1-bis(oxidanylidene)thiolan-3-yl]-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine

Systemtic Name: N2-[1,1-bis(oxidanylidene)thiolan-3-yl]-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine Openeye Name: 6-tert-butoxy-N2-(1,1-dioxothiolan-3-yl)pyridine-2,5-diamine CAS Name: N2-(1,1-dioxo-3-thiolanyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine IUPAC Name: 2-N-(1,1-dioxothiolan-3-yl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine Traditional Name: (5-amino-6-tert-butoxy-2-pyridyl)-(1,1-diketothiolan-3-yl)amine Formula: C13H21N3O3S MolecularWeight: 299.38914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC1=C(C=CC(=N1)NC2CCS(=O)(=O)C2)N

Isomeric SMILES

CC(C)(C)OC1=C(C=CC(=N1)NC2CCS(=O)(=O)C2)N

InChI

InChI=1S/C13H21N3O3S/c1-13(2,3)19-12-10(14)4-5-11(16-12)15-9-6-7-20(17,18)8-9/h4-5,9H,6-8,14H2,1-3H3,(H,15,16)