6-methylsulfanyl-2-(1-phenylbutoxy)-3,1-benzoxazin-4-one

Systemtic Name: 6-methylsulfanyl-2-(1-phenylbutoxy)-3,1-benzoxazin-4-one Openeye Name: 6-methylsulfanyl-2-(1-phenylbutoxy)-3,1-benzoxazin-4-one CAS Name: 6-(methylthio)-2-(1-phenylbutoxy)-3,1-benzoxazin-4-one IUPAC Name: 6-methylsulfanyl-2-(1-phenylbutoxy)-3,1-benzoxazin-4-one Traditional Name: 6-(methylthio)-2-(1-phenylbutoxy)-3,1-benzoxazin-4-one Formula: C19H19NO3S MolecularWeight: 341.42406

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)OC2=NC3=C(C=C(C=C3)SC)C(=O)O2

Isomeric SMILES

CCCC(C1=CC=CC=C1)OC2=NC3=C(C=C(C=C3)SC)C(=O)O2

InChI

InChI=1S/C19H19NO3S/c1-3-7-17(13-8-5-4-6-9-13)22-19-20-16-11-10-14(24-2)12-15(16)18(21)23-19/h4-6,8-12,17H,3,7H2,1-2H3