7,9-dimethyl-4-methylsulfanyl-2,3-dihydro-1,5-benzothiazepine

Systemtic Name: 7,9-dimethyl-4-methylsulfanyl-2,3-dihydro-1,5-benzothiazepine Openeye Name: 7,9-dimethyl-4-methylsulfanyl-2,3-dihydro-1,5-benzothiazepine CAS Name: 7,9-dimethyl-4-(methylthio)-2,3-dihydro-1,5-benzothiazepine IUPAC Name: 7,9-dimethyl-4-methylsulfanyl-2,3-dihydro-1,5-benzothiazepine Traditional Name: 7,9-dimethyl-4-(methylthio)-2,3-dihydro-1,5-benzothiazepine Formula: C12H15NS2 MolecularWeight: 237.3842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N=C(CCS2)SC)C

Isomeric SMILES

CC1=CC(=C2C(=C1)N=C(CCS2)SC)C

InChI

InChI=1S/C12H15NS2/c1-8-6-9(2)12-10(7-8)13-11(14-3)4-5-15-12/h6-7H,4-5H2,1-3H3