6-[2-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]-1-oxoethyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-[[5-(methylthio)-1,3,4-thiadiazol-2-yl]thio]acetyl]-4H-1,4-benzoxazin-3-one Formula: C13H11N3O3S3 MolecularWeight: 353.43974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(S1)SCC(=O)C2=CC3=C(C=C2)OCC(=O)N3

Isomeric SMILES

CSC1=NN=C(S1)SCC(=O)C2=CC3=C(C=C2)OCC(=O)N3

InChI

InChI=1S/C13H11N3O3S3/c1-20-12-15-16-13(22-12)21-6-9(17)7-2-3-10-8(4-7)14-11(18)5-19-10/h2-4H,5-6H2,1H3,(H,14,18)