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

Systemtic Name: 6-methyl-3-methylsulfanyl-[1,2,4]triazino[5,6-d][3,1]benzoxazepine Openeye Name: 6-methyl-3-methylsulfanyl-[1,2,4]triazino[5,6-d][3,1]benzoxazepine CAS Name: 6-methyl-3-(methylthio)-[1,2,4]triazino[5,6-d][3,1]benzoxazepine IUPAC Name: 6-methyl-3-methylsulfanyl-[1,2,4]triazino[5,6-d][3,1]benzoxazepine Traditional Name: 6-methyl-3-(methylthio)-[1,2,4]triazino[5,6-d][3,1]benzoxazepine Formula: C12H10N4OS MolecularWeight: 258.299

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10N4OS/c1-7-13-9-6-4-3-5-8(9)10-11(17-7)14-12(18-2)16-15-10/h3-6H,1-2H3