2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-1-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]ethanone

Systemtic Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-1-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]ethanone Openeye Name: 2-indan-5-ylsulfanyl-1-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]ethanone CAS Name: 2-(2,3-dihydro-1H-inden-5-ylthio)-1-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]ethanone IUPAC Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-1-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]ethanone Traditional Name: 2-(indan-5-ylthio)-1-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]ethanone Formula: C21H23NOS2 MolecularWeight: 369.54342

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)C(=O)CSC3=CC4=C(CCC4)C=C3

Isomeric SMILES

C[C@H]1CCN(C2=CC=CC=C2S1)C(=O)CSC3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C21H23NOS2/c1-15-11-12-22(19-7-2-3-8-20(19)25-15)21(23)14-24-18-10-9-16-5-4-6-17(16)13-18/h2-3,7-10,13,15H,4-6,11-12,14H2,1H3/t15-/m0/s1