7-methyl-2-octylsulfanyl-3,1-benzoxazin-4-one

Systemtic Name: 7-methyl-2-octylsulfanyl-3,1-benzoxazin-4-one Openeye Name: 7-methyl-2-octylsulfanyl-3,1-benzoxazin-4-one CAS Name: 7-methyl-2-(octylthio)-3,1-benzoxazin-4-one IUPAC Name: 7-methyl-2-octylsulfanyl-3,1-benzoxazin-4-one Traditional Name: 7-methyl-2-(octylthio)-3,1-benzoxazin-4-one Formula: C17H23NO2S MolecularWeight: 305.43502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC1=NC2=C(C=CC(=C2)C)C(=O)O1

Isomeric SMILES

CCCCCCCCSC1=NC2=C(C=CC(=C2)C)C(=O)O1

InChI

InChI=1S/C17H23NO2S/c1-3-4-5-6-7-8-11-21-17-18-15-12-13(2)9-10-14(15)16(19)20-17/h9-10,12H,3-8,11H2,1-2H3