2-(4-methoxyphenyl)sulfanyl-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone

Systemtic Name: 2-(4-methoxyphenyl)sulfanyl-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Openeye Name: 2-(4-methoxyphenyl)sulfanyl-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone CAS Name: 2-[(4-methoxyphenyl)thio]-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone IUPAC Name: 2-(4-methoxyphenyl)sulfanyl-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Traditional Name: 2-[(4-methoxyphenyl)thio]-1-(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)ethanone Formula: C19H21NO2S2 MolecularWeight: 359.50554

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)C(=O)CSC3=CC=C(C=C3)OC

Isomeric SMILES

CC1CCN(C2=CC=CC=C2S1)C(=O)CSC3=CC=C(C=C3)OC

InChI

InChI=1S/C19H21NO2S2/c1-14-11-12-20(17-5-3-4-6-18(17)24-14)19(21)13-23-16-9-7-15(22-2)8-10-16/h3-10,14H,11-13H2,1-2H3