ethyl 2-[(6,8-dimethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethanoate

Systemtic Name: ethyl 2-[(6,8-dimethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethanoate Openeye Name: ethyl 2-[(6,8-dimethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetate CAS Name: 2-[(6,8-dimethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(6,8-dimethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetate Traditional Name: 2-[(6,8-dimethyl-5H-[1,2,4]triazin[5,6-b]indol-3-yl)thio]acetic acid ethyl ester Formula: C15H16N4O2S MolecularWeight: 316.37814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC2=C(C3=CC(=CC(=C3N2)C)C)N=N1

Isomeric SMILES

CCOC(=O)CSC1=NC2=C(C3=CC(=CC(=C3N2)C)C)N=N1

InChI

InChI=1S/C15H16N4O2S/c1-4-21-11(20)7-22-15-17-14-13(18-19-15)10-6-8(2)5-9(3)12(10)16-14/h5-6H,4,7H2,1-3H3,(H,16,17,19)