2-methoxy-1-(4-methylsulfanyl-2-phenyl-2H-1,5-benzothiazepin-5-yl)ethanone

Systemtic Name: 2-methoxy-1-(4-methylsulfanyl-2-phenyl-2H-1,5-benzothiazepin-5-yl)ethanone Openeye Name: 2-methoxy-1-(4-methylsulfanyl-2-phenyl-2H-1,5-benzothiazepin-5-yl)ethanone CAS Name: 2-methoxy-1-[4-(methylthio)-2-phenyl-2H-1,5-benzothiazepin-5-yl]ethanone IUPAC Name: 2-methoxy-1-(4-methylsulfanyl-2-phenyl-2H-1,5-benzothiazepin-5-yl)ethanone Traditional Name: 2-methoxy-1-[4-(methylthio)-2-phenyl-2H-1,5-benzothiazepin-5-yl]ethanone Formula: C19H19NO2S2 MolecularWeight: 357.48966

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)N1C2=CC=CC=C2SC(C=C1SC)C3=CC=CC=C3

Isomeric SMILES

COCC(=O)N1C2=CC=CC=C2SC(C=C1SC)C3=CC=CC=C3

InChI

InChI=1S/C19H19NO2S2/c1-22-13-18(21)20-15-10-6-7-11-16(15)24-17(12-19(20)23-2)14-8-4-3-5-9-14/h3-12,17H,13H2,1-2H3