6-ethyl-3-propylsulfanyl-[1,2,4]triazino[5,6-d][3,1]benzoxazepine

Systemtic Name: 6-ethyl-3-propylsulfanyl-[1,2,4]triazino[5,6-d][3,1]benzoxazepine Openeye Name: 6-ethyl-3-propylsulfanyl-[1,2,4]triazino[5,6-d][3,1]benzoxazepine CAS Name: 6-ethyl-3-(propylthio)-[1,2,4]triazino[5,6-d][3,1]benzoxazepine IUPAC Name: 6-ethyl-3-propylsulfanyl-[1,2,4]triazino[5,6-d][3,1]benzoxazepine Traditional Name: 6-ethyl-3-(propylthio)-[1,2,4]triazino[5,6-d][3,1]benzoxazepine Formula: C15H16N4OS MolecularWeight: 300.37874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC2=C(C3=CC=CC=C3N=C(O2)CC)N=N1

Isomeric SMILES

CCCSC1=NC2=C(C3=CC=CC=C3N=C(O2)CC)N=N1

InChI

InChI=1S/C15H16N4OS/c1-3-9-21-15-17-14-13(18-19-15)10-7-5-6-8-11(10)16-12(4-2)20-14/h5-8H,3-4,9H2,1-2H3