7,8-bis(methylsulfanyl)-3,4-dihydro-2H-1,4-benzothiazepin-5-one

Systemtic Name: 7,8-bis(methylsulfanyl)-3,4-dihydro-2H-1,4-benzothiazepin-5-one Openeye Name: 7,8-bis(methylsulfanyl)-3,4-dihydro-2H-1,4-benzothiazepin-5-one CAS Name: 7,8-bis(methylthio)-3,4-dihydro-2H-1,4-benzothiazepin-5-one IUPAC Name: 7,8-bis(methylsulfanyl)-3,4-dihydro-2H-1,4-benzothiazepin-5-one Traditional Name: 7,8-bis(methylthio)-3,4-dihydro-2H-1,4-benzothiazepin-5-one Formula: C11H13NOS3 MolecularWeight: 271.42202

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C2C(=C1)C(=O)NCCS2)SC

Isomeric SMILES

CSC1=C(C=C2C(=C1)C(=O)NCCS2)SC

InChI

InChI=1S/C11H13NOS3/c1-14-9-5-7-8(6-10(9)15-2)16-4-3-12-11(7)13/h5-6H,3-4H2,1-2H3,(H,12,13)