7-azanyl-6-butan-2-ylsulfanyl-4H-1,4-benzoxazin-3-one

Systemtic Name: 7-azanyl-6-butan-2-ylsulfanyl-4H-1,4-benzoxazin-3-one Openeye Name: 7-amino-6-sec-butylsulfanyl-4H-1,4-benzoxazin-3-one CAS Name: 7-amino-6-(butan-2-ylthio)-4H-1,4-benzoxazin-3-one IUPAC Name: 7-amino-6-butan-2-ylsulfanyl-4H-1,4-benzoxazin-3-one Traditional Name: 7-amino-6-(sec-butylthio)-4H-1,4-benzoxazin-3-one Formula: C12H16N2O2S MolecularWeight: 252.33264

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=C(C=C2C(=C1)NC(=O)CO2)N

Isomeric SMILES

CCC(C)SC1=C(C=C2C(=C1)NC(=O)CO2)N

InChI

InChI=1S/C12H16N2O2S/c1-3-7(2)17-11-5-9-10(4-8(11)13)16-6-12(15)14-9/h4-5,7H,3,6,13H2,1-2H3,(H,14,15)