1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-pyridin-2-ylsulfanyl-ethanone

Systemtic Name: 1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-pyridin-2-ylsulfanyl-ethanone Openeye Name: 1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-(2-pyridylsulfanyl)ethanone CAS Name: 1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-(2-pyridinylthio)ethanone IUPAC Name: 1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-pyridin-2-ylsulfanylethanone Traditional Name: 1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-(2-pyridylthio)ethanone Formula: C17H18N2OS2 MolecularWeight: 330.46762

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)C(=O)CSC3=CC=CC=N3

Isomeric SMILES

CC1CCN(C2=CC=CC=C2S1)C(=O)CSC3=CC=CC=N3

InChI

InChI=1S/C17H18N2OS2/c1-13-9-11-19(14-6-2-3-7-15(14)22-13)17(20)12-21-16-8-4-5-10-18-16/h2-8,10,13H,9,11-12H2,1H3