8-methoxy-5-methylsulfanyl-3,4-dihydro-2H-1,6-benzothiazocine

Systemtic Name: 8-methoxy-5-methylsulfanyl-3,4-dihydro-2H-1,6-benzothiazocine Openeye Name: 8-methoxy-5-methylsulfanyl-3,4-dihydro-2H-1,6-benzothiazocine CAS Name: 8-methoxy-5-(methylthio)-3,4-dihydro-2H-1,6-benzothiazocine IUPAC Name: 8-methoxy-5-methylsulfanyl-3,4-dihydro-2H-1,6-benzothiazocine Traditional Name: 8-methoxy-5-(methylthio)-3,4-dihydro-2H-1,6-benzothiazocine Formula: C12H15NOS2 MolecularWeight: 253.3836

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SCCCC(=N2)SC

Isomeric SMILES

COC1=CC2=C(C=C1)SCCCC(=N2)SC

InChI

InChI=1S/C12H15NOS2/c1-14-9-5-6-11-10(8-9)13-12(15-2)4-3-7-16-11/h5-6,8H,3-4,7H2,1-2H3