6-[[(3-tert-butyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]-2-ethoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[(3-tert-butyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]-2-ethoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[(3-tert-butyl-5-thioxo-1H-1,2,4-triazol-4-yl)amino]methylene]-2-ethoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[[(3-tert-butyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]-2-ethoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[(3-tert-butyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]-2-ethoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[[(3-tert-butyl-5-thioxo-1H-1,2,4-triazol-4-yl)amino]methylene]-2-ethoxy-cyclohexa-2,4-dien-1-one Formula: C15H20N4O2S MolecularWeight: 320.4099

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=CNN2C(=NNC2=S)C(C)(C)C)C1=O

Isomeric SMILES

CCOC1=CC=CC(=CNN2C(=NNC2=S)C(C)(C)C)C1=O

InChI

InChI=1S/C15H20N4O2S/c1-5-21-11-8-6-7-10(12(11)20)9-16-19-13(15(2,3)4)17-18-14(19)22/h6-9,16H,5H2,1-4H3,(H,18,22)