7-azanyl-6-butylsulfanyl-4H-1,4-benzoxazin-3-one

Systemtic Name: 7-azanyl-6-butylsulfanyl-4H-1,4-benzoxazin-3-one Openeye Name: 7-amino-6-butylsulfanyl-4H-1,4-benzoxazin-3-one CAS Name: 7-amino-6-(butylthio)-4H-1,4-benzoxazin-3-one IUPAC Name: 7-amino-6-butylsulfanyl-4H-1,4-benzoxazin-3-one Traditional Name: 7-amino-6-(butylthio)-4H-1,4-benzoxazin-3-one Formula: C12H16N2O2S MolecularWeight: 252.33264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=C(C=C2C(=C1)NC(=O)CO2)N

Isomeric SMILES

CCCCSC1=C(C=C2C(=C1)NC(=O)CO2)N

InChI

InChI=1S/C12H16N2O2S/c1-2-3-4-17-11-6-9-10(5-8(11)13)16-7-12(15)14-9/h5-6H,2-4,7,13H2,1H3,(H,14,15)