6-methyl-3-prop-2-enylsulfanyl-[1,2,4]triazino[5,6-d][3,1]benzoxazepine

Systemtic Name: 6-methyl-3-prop-2-enylsulfanyl-[1,2,4]triazino[5,6-d][3,1]benzoxazepine Openeye Name: 3-allylsulfanyl-6-methyl-[1,2,4]triazino[5,6-d][3,1]benzoxazepine CAS Name: 6-methyl-3-(prop-2-enylthio)-[1,2,4]triazino[5,6-d][3,1]benzoxazepine IUPAC Name: 6-methyl-3-prop-2-enylsulfanyl-[1,2,4]triazino[5,6-d][3,1]benzoxazepine Traditional Name: 3-(allylthio)-6-methyl-[1,2,4]triazino[5,6-d][3,1]benzoxazepine Formula: C14H12N4OS MolecularWeight: 284.33628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C3=C(O1)N=C(N=N3)SCC=C

Isomeric SMILES

CC1=NC2=CC=CC=C2C3=C(O1)N=C(N=N3)SCC=C

InChI

InChI=1S/C14H12N4OS/c1-3-8-20-14-16-13-12(17-18-14)10-6-4-5-7-11(10)15-9(2)19-13/h3-7H,1,8H2,2H3