1-[6-[(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)sulfonyl]-2,3-dihydro-1,4-benzothiazin-4-yl]ethanone

Systemtic Name: 1-[6-[(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)sulfonyl]-2,3-dihydro-1,4-benzothiazin-4-yl]ethanone Openeye Name: 1-[6-[(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)sulfonyl]-2,3-dihydro-1,4-benzothiazin-4-yl]ethanone CAS Name: 1-[6-[(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)sulfonyl]-2,3-dihydro-1,4-benzothiazin-4-yl]ethanone IUPAC Name: 1-[6-[(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)sulfonyl]-2,3-dihydro-1,4-benzothiazin-4-yl]ethanone Traditional Name: 1-[6-[(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)sulfonyl]-2,3-dihydro-1,4-benzothiazin-4-yl]ethanone Formula: C20H22N2O3S3 MolecularWeight: 434.59528

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)S(=O)(=O)C3=CC4=C(C=C3)SCCN4C(=O)C

Isomeric SMILES

CC1CCN(C2=CC=CC=C2S1)S(=O)(=O)C3=CC4=C(C=C3)SCCN4C(=O)C

InChI

InChI=1S/C20H22N2O3S3/c1-14-9-10-22(17-5-3-4-6-20(17)27-14)28(24,25)16-7-8-19-18(13-16)21(15(2)23)11-12-26-19/h3-8,13-14H,9-12H2,1-2H3