2-(5-ethanoyl-2-methoxy-phenyl)-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone

Systemtic Name: 2-(5-ethanoyl-2-methoxy-phenyl)-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Openeye Name: 2-(5-acetyl-2-methoxy-phenyl)-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone CAS Name: 2-(5-acetyl-2-methoxyphenyl)-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone IUPAC Name: 2-(5-acetyl-2-methoxyphenyl)-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Traditional Name: 2-(5-acetyl-2-methoxy-phenyl)-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Formula: C21H23NO3S MolecularWeight: 369.47722

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)C(=O)CC3=C(C=CC(=C3)C(=O)C)OC

Isomeric SMILES

CC1CCN(C2=CC=CC=C2S1)C(=O)CC3=C(C=CC(=C3)C(=O)C)OC

InChI

InChI=1S/C21H23NO3S/c1-14-10-11-22(18-6-4-5-7-20(18)26-14)21(24)13-17-12-16(15(2)23)8-9-19(17)25-3/h4-9,12,14H,10-11,13H2,1-3H3