8-methyl-2-(phenylmethylsulfanyl)-3,1-benzoxazin-4-one

Systemtic Name: 8-methyl-2-(phenylmethylsulfanyl)-3,1-benzoxazin-4-one Openeye Name: 2-benzylsulfanyl-8-methyl-3,1-benzoxazin-4-one CAS Name: 8-methyl-2-(phenylmethylthio)-3,1-benzoxazin-4-one IUPAC Name: 2-benzylsulfanyl-8-methyl-3,1-benzoxazin-4-one Traditional Name: 2-(benzylthio)-8-methyl-3,1-benzoxazin-4-one Formula: C16H13NO2S MolecularWeight: 283.34492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(OC2=O)SCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC2=C1N=C(OC2=O)SCC3=CC=CC=C3

InChI

InChI=1S/C16H13NO2S/c1-11-6-5-9-13-14(11)17-16(19-15(13)18)20-10-12-7-3-2-4-8-12/h2-9H,10H2,1H3