3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(2-methoxy-4-methylsulfanyl-phenyl)methanone

Systemtic Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(2-methoxy-4-methylsulfanyl-phenyl)methanone Openeye Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(2-methoxy-4-methylsulfanyl-phenyl)methanone CAS Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[2-methoxy-4-(methylthio)phenyl]methanone IUPAC Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-(2-methoxy-4-methylsulfanylphenyl)methanone Traditional Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[2-methoxy-4-(methylthio)phenyl]methanone Formula: C18H19NO2S2 MolecularWeight: 345.47896

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)SC)C(=O)N2CCCSC3=CC=CC=C32

Isomeric SMILES

COC1=C(C=CC(=C1)SC)C(=O)N2CCCSC3=CC=CC=C32

InChI

InChI=1S/C18H19NO2S2/c1-21-16-12-13(22-2)8-9-14(16)18(20)19-10-5-11-23-17-7-4-3-6-15(17)19/h3-4,6-9,12H,5,10-11H2,1-2H3